data_18755
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18755
_Entry.PDB_ID 2LZG
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 18755
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 CYS N N 2 123.192 123.192 119.317 3.875 18755
2 1 1 . 1 1 2 2 CYS H H 2 8.252 8.252 9.246 -0.994 18755
3 1 1 . 1 1 3 3 ASN N N 3 123.749 123.749 119.184 4.565 18755
4 1 1 . 1 1 3 3 ASN H H 3 8.128 8.128 8.672 -0.544 18755
5 1 1 . 1 1 6 6 MET N N 6 119.009 119.009 119.384 -0.375 18755
6 1 1 . 1 1 6 6 MET CA C 6 43.265 43.265 54.391 -11.126 18755
7 1 1 . 1 1 6 6 MET CB C 6 27.431 27.431 35.242 -7.811 18755
8 1 1 . 1 1 6 6 MET H H 6 7.099 7.099 8.244 -1.145 18755
9 1 1 . 1 1 7 7 SER N N 7 119.000 119.000 119.589 -0.589 18755
10 1 1 . 1 1 7 7 SER HA H 7 4.337 4.337 4.495 -0.158 18755
11 1 1 . 1 1 7 7 SER C C 7 177.600 177.600 173.976 3.624 18755
12 1 1 . 1 1 7 7 SER CA C 7 57.850 57.850 59.058 -1.208 18755
13 1 1 . 1 1 7 7 SER CB C 7 63.720 63.720 62.241 1.479 18755
14 1 1 . 1 1 7 7 SER H H 7 8.246 8.246 8.506 -0.260 18755
15 1 1 . 1 1 8 8 VAL N N 8 126.800 126.800 124.869 1.931 18755
16 1 1 . 1 1 8 8 VAL HA H 8 4.290 4.290 4.456 -0.166 18755
17 1 1 . 1 1 8 8 VAL C C 8 180.600 180.600 173.703 6.897 18755
18 1 1 . 1 1 8 8 VAL CA C 8 55.790 55.790 59.667 -3.877 18755
19 1 1 . 1 1 8 8 VAL CB C 8 41.860 41.860 34.702 7.158 18755
20 1 1 . 1 1 8 8 VAL H H 8 7.988 7.988 7.867 0.121 18755
21 1 1 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.748 -0.397 18755
22 1 1 . 1 1 9 9 PRO C C 9 176.757 176.757 176.412 0.345 18755
23 1 1 . 1 1 10 10 THR N N 10 113.463 113.463 111.914 1.549 18755
24 1 1 . 1 1 10 10 THR HA H 10 4.235 4.235 4.362 -0.127 18755
25 1 1 . 1 1 10 10 THR C C 10 174.000 174.000 175.395 -1.395 18755
26 1 1 . 1 1 10 10 THR CA C 10 61.265 61.265 64.208 -2.943 18755
27 1 1 . 1 1 10 10 THR CB C 10 69.466 69.466 69.594 -0.128 18755
28 1 1 . 1 1 10 10 THR H H 10 8.109 8.109 8.131 -0.022 18755
29 1 1 . 1 1 11 11 ASP N N 11 122.009 122.009 121.394 0.615 18755
30 1 1 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.529 -0.106 18755
31 1 1 . 1 1 11 11 ASP C C 11 175.900 175.900 177.206 -1.306 18755
32 1 1 . 1 1 11 11 ASP CA C 11 54.245 54.245 54.141 0.104 18755
33 1 1 . 1 1 11 11 ASP CB C 11 40.957 40.957 40.103 0.854 18755
34 1 1 . 1 1 11 11 ASP H H 11 8.180 8.180 8.257 -0.077 18755
35 1 1 . 1 1 12 12 GLY N N 12 108.549 108.549 108.515 0.034 18755
36 1 1 . 1 1 12 12 GLY C C 12 171.700 171.700 172.609 -0.909 18755
37 1 1 . 1 1 12 12 GLY CA C 12 44.481 44.481 45.119 -0.638 18755
38 1 1 . 1 1 12 12 GLY H H 12 7.409 7.409 8.019 -0.610 18755
39 1 1 . 1 1 13 13 ALA N N 13 119.600 119.600 122.588 -2.988 18755
40 1 1 . 1 1 13 13 ALA HA H 13 4.302 4.302 3.439 0.863 18755
41 1 1 . 1 1 13 13 ALA C C 13 176.400 176.400 174.329 2.071 18755
42 1 1 . 1 1 13 13 ALA CA C 13 51.676 51.676 50.683 0.993 18755
43 1 1 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.546 0.100 18755
44 1 1 . 1 1 13 13 ALA H H 13 7.288 7.288 6.453 0.835 18755
45 1 1 . 1 1 14 14 VAL N N 14 118.098 118.098 118.460 -0.362 18755
46 1 1 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.423 0.125 18755
47 1 1 . 1 1 14 14 VAL C C 14 174.300 174.300 175.354 -1.054 18755
48 1 1 . 1 1 14 14 VAL CA C 14 60.637 60.637 60.717 -0.080 18755
49 1 1 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.658 0.515 18755
50 1 1 . 1 1 14 14 VAL H H 14 8.091 8.091 8.706 -0.615 18755
51 1 1 . 1 1 15 15 THR N N 15 116.900 116.900 117.724 -0.824 18755
52 1 1 . 1 1 15 15 THR HA H 15 4.750 4.750 4.622 0.128 18755
53 1 1 . 1 1 15 15 THR C C 15 173.364 173.364 173.029 0.335 18755
54 1 1 . 1 1 15 15 THR CA C 15 60.011 60.011 61.840 -1.829 18755
55 1 1 . 1 1 15 15 THR CB C 15 71.125 71.125 71.438 -0.313 18755
56 1 1 . 1 1 15 15 THR H H 15 8.303 8.303 8.415 -0.112 18755
57 1 1 . 1 1 16 16 THR N N 16 116.004 116.004 117.761 -1.757 18755
58 1 1 . 1 1 16 16 THR HA H 16 4.678 4.678 4.291 0.387 18755
59 1 1 . 1 1 16 16 THR C C 16 173.665 173.665 173.603 0.062 18755
60 1 1 . 1 1 16 16 THR CA C 16 57.028 57.028 60.620 -3.592 18755
61 1 1 . 1 1 16 16 THR CB C 16 67.263 67.263 71.764 -4.501 18755
62 1 1 . 1 1 16 16 THR H H 16 8.352 8.352 8.160 0.192 18755
63 1 1 . 1 1 17 17 SER N N 17 121.926 121.926 115.292 6.634 18755
64 1 1 . 1 1 17 17 SER HA H 17 4.440 4.440 4.694 -0.254 18755
65 1 1 . 1 1 17 17 SER CA C 17 58.639 58.639 59.267 -0.628 18755
66 1 1 . 1 1 17 17 SER CB C 17 63.087 63.087 64.622 -1.535 18755
67 1 1 . 1 1 17 17 SER H H 17 8.566 8.566 8.789 -0.223 18755
68 1 1 . 1 1 18 18 GLN N N 18 121.238 121.238 119.790 1.448 18755
69 1 1 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.384 -0.436 18755
70 1 1 . 1 1 18 18 GLN C C 18 174.237 174.237 174.591 -0.354 18755
71 1 1 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.350 0.135 18755
72 1 1 . 1 1 18 18 GLN CB C 18 29.687 29.687 30.175 -0.489 18755
73 1 1 . 1 1 18 18 GLN H H 18 9.115 9.115 8.608 0.507 18755
74 1 1 . 1 1 19 19 ILE N N 19 117.894 117.894 113.773 4.121 18755
75 1 1 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.270 0.060 18755
76 1 1 . 1 1 19 19 ILE C C 19 173.200 173.200 172.751 0.449 18755
77 1 1 . 1 1 19 19 ILE CA C 19 54.716 54.716 58.754 -4.038 18755
78 1 1 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.394 1.664 18755
79 1 1 . 1 1 19 19 ILE H H 19 6.487 6.487 8.139 -1.652 18755
80 1 1 . 1 1 21 21 ALA N N 21 128.900 128.900 121.233 7.667 18755
81 1 1 . 1 1 21 21 ALA HA H 21 3.890 3.890 3.960 -0.070 18755
82 1 1 . 1 1 21 21 ALA C C 21 180.600 180.600 179.568 1.032 18755
83 1 1 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.527 0.381 18755
84 1 1 . 1 1 21 21 ALA CB C 21 17.767 17.767 18.426 -0.659 18755
85 1 1 . 1 1 21 21 ALA H H 21 8.867 8.867 8.070 0.797 18755
86 1 1 . 1 1 22 22 SER N N 22 111.315 111.315 111.987 -0.672 18755
87 1 1 . 1 1 22 22 SER HA H 22 3.787 3.787 4.096 -0.309 18755
88 1 1 . 1 1 22 22 SER C C 22 178.400 178.400 175.832 2.568 18755
89 1 1 . 1 1 22 22 SER CA C 22 61.138 61.138 61.138 0.000 18755
90 1 1 . 1 1 22 22 SER CB C 22 60.854 60.854 62.660 -1.806 18755
91 1 1 . 1 1 22 22 SER H H 22 8.752 8.752 8.231 0.521 18755
92 1 1 . 1 1 23 23 GLU N N 23 122.700 122.700 118.820 3.880 18755
93 1 1 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.384 -0.376 18755
94 1 1 . 1 1 23 23 GLU C C 23 179.100 179.100 177.105 1.995 18755
95 1 1 . 1 1 23 23 GLU CA C 23 58.515 58.515 57.070 1.445 18755
96 1 1 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.222 -0.864 18755
97 1 1 . 1 1 23 23 GLU H H 23 6.949 6.949 7.592 -0.643 18755
98 1 1 . 1 1 24 24 GLN N N 24 118.007 118.007 115.919 2.088 18755
99 1 1 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.445 0.028 18755
100 1 1 . 1 1 24 24 GLN C C 24 175.200 175.200 176.059 -0.859 18755
101 1 1 . 1 1 24 24 GLN CA C 24 57.851 57.851 54.070 3.781 18755
102 1 1 . 1 1 24 24 GLN CB C 24 29.025 29.025 29.167 -0.142 18755
103 1 1 . 1 1 24 24 GLN H H 24 7.419 7.419 7.879 -0.460 18755
104 1 1 . 1 1 25 25 GLU N N 25 114.406 114.406 122.925 -8.519 18755
105 1 1 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.334 -0.038 18755
106 1 1 . 1 1 25 25 GLU C C 25 175.500 175.500 175.276 0.224 18755
107 1 1 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.568 -0.718 18755
108 1 1 . 1 1 25 25 GLU CB C 25 29.660 29.660 28.305 1.355 18755
109 1 1 . 1 1 25 25 GLU H H 25 7.148 7.148 8.327 -1.179 18755
110 1 1 . 1 1 26 26 THR N N 26 116.297 116.297 117.597 -1.300 18755
111 1 1 . 1 1 26 26 THR HA H 26 3.808 3.808 4.590 -0.782 18755
112 1 1 . 1 1 26 26 THR C C 26 172.700 172.700 172.953 -0.253 18755
113 1 1 . 1 1 26 26 THR CA C 26 64.750 64.750 61.770 2.981 18755
114 1 1 . 1 1 26 26 THR CB C 26 69.899 69.899 70.810 -0.911 18755
115 1 1 . 1 1 26 26 THR H H 26 7.178 7.178 8.347 -1.169 18755
116 1 1 . 1 1 27 27 LEU N N 27 128.394 128.394 129.957 -1.563 18755
117 1 1 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.350 0.424 18755
118 1 1 . 1 1 27 27 LEU C C 27 176.600 176.600 174.762 1.838 18755
119 1 1 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.642 -1.076 18755
120 1 1 . 1 1 27 27 LEU CB C 27 42.977 42.977 43.368 -0.391 18755
121 1 1 . 1 1 27 27 LEU H H 27 8.381 8.381 8.810 -0.429 18755
122 1 1 . 1 1 28 28 VAL N N 28 117.407 117.407 122.814 -5.407 18755
123 1 1 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.377 -0.269 18755
124 1 1 . 1 1 28 28 VAL C C 28 173.600 173.600 174.534 -0.934 18755
125 1 1 . 1 1 28 28 VAL CA C 28 58.968 58.968 58.453 0.515 18755
126 1 1 . 1 1 28 28 VAL CB C 28 36.828 36.828 35.062 1.766 18755
127 1 1 . 1 1 28 28 VAL H H 28 9.682 9.682 8.857 0.825 18755
128 1 1 . 1 1 29 29 ARG N N 29 121.300 121.300 126.961 -5.661 18755
129 1 1 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.743 0.493 18755
130 1 1 . 1 1 29 29 ARG C C 29 174.700 174.700 174.140 0.560 18755
131 1 1 . 1 1 29 29 ARG CA C 29 52.103 52.103 53.018 -0.915 18755
132 1 1 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.053 1.066 18755
133 1 1 . 1 1 29 29 ARG H H 29 9.164 9.164 7.915 1.249 18755
134 1 1 . 1 1 33 33 LEU N N 33 118.497 118.497 121.051 -2.554 18755
135 1 1 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.218 -0.155 18755
136 1 1 . 1 1 33 33 LEU C C 33 178.140 178.140 178.249 -0.109 18755
137 1 1 . 1 1 33 33 LEU CA C 33 57.855 57.855 57.254 0.601 18755
138 1 1 . 1 1 33 33 LEU CB C 33 41.146 41.146 41.826 -0.680 18755
139 1 1 . 1 1 33 33 LEU H H 33 8.807 8.807 8.430 0.377 18755
140 1 1 . 1 1 34 34 LEU N N 34 118.106 118.106 120.926 -2.820 18755
141 1 1 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.911 0.016 18755
142 1 1 . 1 1 34 34 LEU C C 34 177.700 177.700 178.583 -0.883 18755
143 1 1 . 1 1 34 34 LEU CA C 34 56.526 56.526 57.974 -1.448 18755
144 1 1 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.211 -0.810 18755
145 1 1 . 1 1 34 34 LEU H H 34 7.298 7.298 7.622 -0.324 18755
146 1 1 . 1 1 35 35 LEU N N 35 119.900 119.900 113.005 6.895 18755
147 1 1 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.114 -0.432 18755
148 1 1 . 1 1 35 35 LEU C C 35 177.500 177.500 178.403 -0.903 18755
149 1 1 . 1 1 35 35 LEU CA C 35 57.820 57.820 56.718 1.102 18755
150 1 1 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.146 1.111 18755
151 1 1 . 1 1 35 35 LEU H H 35 8.521 8.521 8.244 0.277 18755
152 1 1 . 1 1 36 36 LYS N N 36 118.000 118.000 119.901 -1.901 18755
153 1 1 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.083 -0.356 18755
154 1 1 . 1 1 36 36 LYS C C 36 179.100 179.100 178.874 0.226 18755
155 1 1 . 1 1 36 36 LYS CA C 36 59.338 59.338 59.073 0.265 18755
156 1 1 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.764 -0.852 18755
157 1 1 . 1 1 36 36 LYS H H 36 7.824 7.824 8.282 -0.458 18755
158 1 1 . 1 1 37 37 LEU N N 37 120.701 120.701 120.348 0.353 18755
159 1 1 . 1 1 37 37 LEU HA H 37 3.668 3.668 3.919 -0.251 18755
160 1 1 . 1 1 37 37 LEU C C 37 180.200 180.200 178.597 1.603 18755
161 1 1 . 1 1 37 37 LEU CA C 37 59.088 59.088 58.046 1.042 18755
162 1 1 . 1 1 37 37 LEU CB C 37 40.927 40.927 41.904 -0.977 18755
163 1 1 . 1 1 37 37 LEU H H 37 7.230 7.230 7.458 -0.228 18755
164 1 1 . 1 1 38 38 LEU N N 38 120.600 120.600 115.836 4.764 18755
165 1 1 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.767 -0.307 18755
166 1 1 . 1 1 38 38 LEU C C 38 178.900 178.900 178.562 0.338 18755
167 1 1 . 1 1 38 38 LEU CA C 38 57.802 57.802 57.979 -0.177 18755
168 1 1 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.577 -1.293 18755
169 1 1 . 1 1 38 38 LEU H H 38 8.124 8.124 7.524 0.600 18755
170 1 1 . 1 1 39 39 LYS N N 39 118.000 118.000 118.690 -0.690 18755
171 1 1 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.052 0.111 18755
172 1 1 . 1 1 39 39 LYS C C 39 180.108 180.108 177.668 2.440 18755
173 1 1 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.743 0.262 18755
174 1 1 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.238 -2.516 18755
175 1 1 . 1 1 39 39 LYS H H 39 8.678 8.678 7.691 0.987 18755
176 1 1 . 1 1 40 40 SER N N 40 116.993 116.993 113.417 3.576 18755
177 1 1 . 1 1 40 40 SER HA H 40 4.269 4.269 4.349 -0.080 18755
178 1 1 . 1 1 40 40 SER C C 40 175.000 175.000 175.880 -0.880 18755
179 1 1 . 1 1 40 40 SER CA C 40 61.287 61.287 60.516 0.771 18755
180 1 1 . 1 1 40 40 SER CB C 40 62.907 62.907 63.619 -0.712 18755
181 1 1 . 1 1 40 40 SER H H 40 7.763 7.763 7.837 -0.074 18755
182 1 1 . 1 1 41 41 VAL N N 41 112.903 112.903 117.727 -4.824 18755
183 1 1 . 1 1 41 41 VAL HA H 41 4.667 4.667 4.377 0.290 18755
184 1 1 . 1 1 41 41 VAL C C 41 175.300 175.300 176.990 -1.690 18755
185 1 1 . 1 1 41 41 VAL CA C 41 60.235 60.235 63.012 -2.777 18755
186 1 1 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.605 -1.990 18755
187 1 1 . 1 1 41 41 VAL H H 41 7.143 7.143 7.509 -0.366 18755
188 1 1 . 1 1 42 42 GLY N N 42 105.906 105.906 106.256 -0.350 18755
189 1 1 . 1 1 42 42 GLY C C 42 174.300 174.300 173.607 0.693 18755
190 1 1 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.861 0.271 18755
191 1 1 . 1 1 42 42 GLY H H 42 7.354 7.354 7.574 -0.220 18755
192 1 1 . 1 1 43 43 ALA N N 43 125.097 125.097 125.121 -0.024 18755
193 1 1 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.633 0.268 18755
194 1 1 . 1 1 43 43 ALA C C 43 177.900 177.900 177.060 0.840 18755
195 1 1 . 1 1 43 43 ALA CA C 43 53.000 53.000 52.097 0.903 18755
196 1 1 . 1 1 43 43 ALA CB C 43 18.064 18.064 17.276 0.788 18755
197 1 1 . 1 1 43 43 ALA H H 43 7.246 7.246 7.926 -0.680 18755
198 1 1 . 1 1 44 44 GLN N N 44 118.000 118.000 123.057 -5.057 18755
199 1 1 . 1 1 44 44 GLN H H 44 8.676 8.676 8.261 0.415 18755
200 1 1 . 1 1 45 45 LYS N N 45 117.985 117.985 120.083 -2.098 18755
201 1 1 . 1 1 45 45 LYS H H 45 7.247 7.247 7.539 -0.292 18755
202 1 1 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.330 0.131 18755
203 1 1 . 1 1 46 46 ASP CA C 46 55.323 55.323 55.676 -0.353 18755
204 1 1 . 1 1 47 47 THR N N 47 111.306 111.306 109.558 1.748 18755
205 1 1 . 1 1 47 47 THR HA H 47 4.921 4.921 4.379 0.542 18755
206 1 1 . 1 1 47 47 THR C C 47 171.900 171.900 172.518 -0.618 18755
207 1 1 . 1 1 47 47 THR CA C 47 60.259 60.259 60.785 -0.526 18755
208 1 1 . 1 1 47 47 THR CB C 47 71.478 71.478 70.657 0.821 18755
209 1 1 . 1 1 47 47 THR H H 47 6.869 6.869 7.285 -0.416 18755
210 1 1 . 1 1 48 48 TYR N N 48 119.895 119.895 121.105 -1.210 18755
211 1 1 . 1 1 48 48 TYR HA H 48 4.722 4.722 5.012 -0.290 18755
212 1 1 . 1 1 48 48 TYR C C 48 175.700 175.700 176.142 -0.442 18755
213 1 1 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.781 1.185 18755
214 1 1 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.530 4.037 18755
215 1 1 . 1 1 48 48 TYR H H 48 8.614 8.614 8.530 0.084 18755
216 1 1 . 1 1 49 49 THR N N 49 110.720 110.720 114.714 -3.994 18755
217 1 1 . 1 1 49 49 THR HA H 49 5.318 5.318 4.789 0.529 18755
218 1 1 . 1 1 49 49 THR C C 49 178.400 178.400 176.128 2.272 18755
219 1 1 . 1 1 49 49 THR CA C 49 61.019 61.019 60.467 0.552 18755
220 1 1 . 1 1 49 49 THR CB C 49 71.104 71.104 70.636 0.468 18755
221 1 1 . 1 1 49 49 THR H H 49 8.761 8.761 8.870 -0.110 18755
222 1 1 . 1 1 50 50 MET N N 50 121.906 121.906 122.907 -1.001 18755
223 1 1 . 1 1 50 50 MET HA H 50 4.196 4.196 4.217 -0.021 18755
224 1 1 . 1 1 50 50 MET C C 50 178.300 178.300 177.479 0.821 18755
225 1 1 . 1 1 50 50 MET CA C 50 57.557 57.557 57.228 0.329 18755
226 1 1 . 1 1 50 50 MET CB C 50 30.037 30.037 31.886 -1.849 18755
227 1 1 . 1 1 50 50 MET H H 50 7.901 7.901 9.068 -1.167 18755
228 1 1 . 1 1 51 51 LYS N N 51 115.600 115.600 118.536 -2.936 18755
229 1 1 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.196 0.089 18755
230 1 1 . 1 1 51 51 LYS C C 51 179.100 179.100 179.178 -0.078 18755
231 1 1 . 1 1 51 51 LYS CA C 51 59.322 59.322 59.412 -0.090 18755
232 1 1 . 1 1 51 51 LYS CB C 51 32.140 32.140 32.123 0.017 18755
233 1 1 . 1 1 51 51 LYS H H 51 8.413 8.413 7.628 0.785 18755
234 1 1 . 1 1 52 52 GLU N N 52 120.906 120.906 120.163 0.743 18755
235 1 1 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.810 0.593 18755
236 1 1 . 1 1 52 52 GLU C C 52 178.200 178.200 178.326 -0.126 18755
237 1 1 . 1 1 52 52 GLU CA C 52 58.778 58.778 58.893 -0.115 18755
238 1 1 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.538 2.252 18755
239 1 1 . 1 1 52 52 GLU H H 52 7.646 7.646 7.994 -0.348 18755
240 1 1 . 1 1 53 53 VAL N N 53 120.300 120.300 119.888 0.412 18755
241 1 1 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.688 -0.507 18755
242 1 1 . 1 1 53 53 VAL C C 53 177.500 177.500 177.959 -0.459 18755
243 1 1 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.742 0.683 18755
244 1 1 . 1 1 53 53 VAL CB C 53 30.360 30.360 31.017 -0.657 18755
245 1 1 . 1 1 53 53 VAL H H 53 7.972 7.972 8.338 -0.366 18755
246 1 1 . 1 1 54 54 LEU N N 54 120.594 120.594 117.489 3.105 18755
247 1 1 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.017 -0.333 18755
248 1 1 . 1 1 54 54 LEU C C 54 178.900 178.900 179.754 -0.854 18755
249 1 1 . 1 1 54 54 LEU CA C 54 55.110 55.110 56.962 -1.852 18755
250 1 1 . 1 1 54 54 LEU CB C 54 39.237 39.237 39.620 -0.383 18755
251 1 1 . 1 1 54 54 LEU H H 54 8.063 8.063 7.615 0.448 18755
252 1 1 . 1 1 55 55 PHE N N 55 120.300 120.300 120.859 -0.559 18755
253 1 1 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.079 -0.128 18755
254 1 1 . 1 1 55 55 PHE C C 55 177.900 177.900 177.122 0.778 18755
255 1 1 . 1 1 55 55 PHE CA C 55 61.017 61.017 62.047 -1.030 18755
256 1 1 . 1 1 55 55 PHE CB C 55 38.083 38.083 38.740 -0.657 18755
257 1 1 . 1 1 55 55 PHE H H 55 7.339 7.339 7.431 -0.092 18755
258 1 1 . 1 1 56 56 TYR N N 56 119.500 119.500 117.033 2.467 18755
259 1 1 . 1 1 56 56 TYR HA H 56 3.740 3.740 4.007 -0.267 18755
260 1 1 . 1 1 56 56 TYR C C 56 178.200 178.200 178.347 -0.147 18755
261 1 1 . 1 1 56 56 TYR CA C 56 62.737 62.737 60.680 2.057 18755
262 1 1 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.377 1.492 18755
263 1 1 . 1 1 56 56 TYR H H 56 8.074 8.074 7.087 0.988 18755
264 1 1 . 1 1 57 57 LEU N N 57 119.895 119.895 119.603 0.292 18755
265 1 1 . 1 1 57 57 LEU HA H 57 3.858 3.858 3.940 -0.082 18755
266 1 1 . 1 1 57 57 LEU C C 57 178.800 178.800 179.684 -0.884 18755
267 1 1 . 1 1 57 57 LEU CA C 57 57.567 57.567 57.920 -0.353 18755
268 1 1 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.258 0.900 18755
269 1 1 . 1 1 57 57 LEU H H 57 8.628 8.628 8.316 0.312 18755
270 1 1 . 1 1 58 58 GLY N N 58 107.015 107.015 106.513 0.502 18755
271 1 1 . 1 1 58 58 GLY C C 58 175.028 175.028 175.813 -0.785 18755
272 1 1 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.794 0.309 18755
273 1 1 . 1 1 58 58 GLY H H 58 8.245 8.245 8.159 0.086 18755
274 1 1 . 1 1 59 59 GLN N N 59 119.400 119.400 121.345 -1.945 18755
275 1 1 . 1 1 59 59 GLN HA H 59 3.793 3.793 3.904 -0.111 18755
276 1 1 . 1 1 59 59 GLN C C 59 178.900 178.900 177.178 1.722 18755
277 1 1 . 1 1 59 59 GLN CA C 59 58.023 58.023 58.233 -0.210 18755
278 1 1 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.616 0.267 18755
279 1 1 . 1 1 59 59 GLN H H 59 7.400 7.400 8.341 -0.941 18755
280 1 1 . 1 1 60 60 TYR N N 60 123.589 123.589 121.644 1.945 18755
281 1 1 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.129 -0.442 18755
282 1 1 . 1 1 60 60 TYR C C 60 175.700 175.700 177.491 -1.791 18755
283 1 1 . 1 1 60 60 TYR CA C 60 62.621 62.621 61.657 0.964 18755
284 1 1 . 1 1 60 60 TYR CB C 60 38.069 38.069 38.211 -0.142 18755
285 1 1 . 1 1 60 60 TYR H H 60 8.521 8.521 8.175 0.346 18755
286 1 1 . 1 1 61 61 ILE N N 61 118.996 118.996 118.648 0.348 18755
287 1 1 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.326 -0.201 18755
288 1 1 . 1 1 61 61 ILE C C 61 177.600 177.600 177.514 0.086 18755
289 1 1 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.555 0.353 18755
290 1 1 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.577 0.516 18755
291 1 1 . 1 1 61 61 ILE H H 61 8.240 8.240 7.554 0.686 18755
292 1 1 . 1 1 62 62 MET N N 62 115.500 115.500 118.138 -2.638 18755
293 1 1 . 1 1 62 62 MET HA H 62 4.333 4.333 3.912 0.421 18755
294 1 1 . 1 1 62 62 MET C C 62 180.000 180.000 177.743 2.257 18755
295 1 1 . 1 1 62 62 MET CA C 62 57.270 57.270 58.880 -1.610 18755
296 1 1 . 1 1 62 62 MET CB C 62 30.961 30.961 32.692 -1.731 18755
297 1 1 . 1 1 62 62 MET H H 62 7.750 7.750 7.270 0.480 18755
298 1 1 . 1 1 63 63 THR N N 63 117.070 117.070 112.315 4.755 18755
299 1 1 . 1 1 63 63 THR HA H 63 3.865 3.865 4.131 -0.266 18755
300 1 1 . 1 1 63 63 THR C C 63 176.200 176.200 176.173 0.027 18755
301 1 1 . 1 1 63 63 THR CA C 63 65.992 65.992 64.829 1.163 18755
302 1 1 . 1 1 63 63 THR CB C 63 68.857 68.857 69.252 -0.395 18755
303 1 1 . 1 1 63 63 THR H H 63 8.423 8.423 7.857 0.566 18755
304 1 1 . 1 1 64 64 LYS N N 64 118.512 118.512 119.121 -0.609 18755
305 1 1 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.203 -0.249 18755
306 1 1 . 1 1 64 64 LYS C C 64 174.500 174.500 176.023 -1.523 18755
307 1 1 . 1 1 64 64 LYS CA C 64 55.027 55.027 55.271 -0.244 18755
308 1 1 . 1 1 64 64 LYS CB C 64 30.673 30.673 32.470 -1.797 18755
309 1 1 . 1 1 64 64 LYS H H 64 7.678 7.678 7.774 -0.096 18755
310 1 1 . 1 1 65 65 ARG N N 65 115.400 115.400 115.961 -0.561 18755
311 1 1 . 1 1 65 65 ARG HA H 65 3.764 3.764 3.983 -0.219 18755
312 1 1 . 1 1 65 65 ARG C C 65 175.900 175.900 176.480 -0.580 18755
313 1 1 . 1 1 65 65 ARG CA C 65 56.475 56.475 56.589 -0.114 18755
314 1 1 . 1 1 65 65 ARG CB C 65 25.911 25.911 27.069 -1.158 18755
315 1 1 . 1 1 65 65 ARG H H 65 7.467 7.467 7.622 -0.155 18755
316 1 1 . 1 1 66 66 LEU N N 66 115.591 115.591 116.746 -1.155 18755
317 1 1 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.120 0.215 18755
318 1 1 . 1 1 66 66 LEU C C 66 175.400 175.400 176.506 -1.106 18755
319 1 1 . 1 1 66 66 LEU CA C 66 54.526 54.526 55.303 -0.777 18755
320 1 1 . 1 1 66 66 LEU CB C 66 41.682 41.682 41.471 0.211 18755
321 1 1 . 1 1 66 66 LEU H H 66 7.612 7.612 7.373 0.239 18755
322 1 1 . 1 1 67 67 TYR N N 67 116.298 116.298 114.571 1.727 18755
323 1 1 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.196 0.555 18755
324 1 1 . 1 1 67 67 TYR C C 67 173.576 173.576 175.144 -1.568 18755
325 1 1 . 1 1 67 67 TYR CA C 67 55.334 55.334 54.569 0.764 18755
326 1 1 . 1 1 67 67 TYR CB C 67 40.410 40.410 37.734 2.676 18755
327 1 1 . 1 1 67 67 TYR H H 67 7.127 7.127 7.389 -0.262 18755
328 1 1 . 1 1 68 68 ASP N N 68 124.792 124.792 123.808 0.984 18755
329 1 1 . 1 1 68 68 ASP C C 68 175.741 175.741 174.881 0.860 18755
330 1 1 . 1 1 68 68 ASP CA C 68 53.209 53.209 53.709 -0.500 18755
331 1 1 . 1 1 68 68 ASP CB C 68 42.503 42.503 41.830 0.673 18755
332 1 1 . 1 1 68 68 ASP H H 68 8.205 8.205 8.130 0.075 18755
333 1 1 . 1 1 69 69 GLU N N 69 123.507 123.507 118.439 5.068 18755
334 1 1 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.636 -0.839 18755
335 1 1 . 1 1 69 69 GLU C C 69 176.859 176.859 176.695 0.164 18755
336 1 1 . 1 1 69 69 GLU CA C 69 57.980 57.980 54.804 3.176 18755
337 1 1 . 1 1 69 69 GLU CB C 69 29.260 29.260 28.535 0.725 18755
338 1 1 . 1 1 69 69 GLU H H 69 8.440 8.440 8.057 0.383 18755
339 1 1 . 1 1 70 70 LYS N N 70 117.904 117.904 121.567 -3.663 18755
340 1 1 . 1 1 70 70 LYS HA H 70 4.325 4.325 3.815 0.510 18755
341 1 1 . 1 1 70 70 LYS C C 70 177.016 177.016 177.772 -0.756 18755
342 1 1 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.538 -1.498 18755
343 1 1 . 1 1 70 70 LYS CB C 70 32.090 32.090 31.625 0.465 18755
344 1 1 . 1 1 70 70 LYS H H 70 8.208 8.208 8.591 -0.383 18755
345 1 1 . 1 1 71 71 GLN N N 71 118.762 118.762 119.438 -0.676 18755
346 1 1 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.173 0.152 18755
347 1 1 . 1 1 71 71 GLN C C 71 175.300 175.300 176.571 -1.271 18755
348 1 1 . 1 1 71 71 GLN CA C 71 54.920 54.920 57.633 -2.713 18755
349 1 1 . 1 1 71 71 GLN CB C 71 28.850 28.850 28.955 -0.105 18755
350 1 1 . 1 1 71 71 GLN H H 71 7.934 7.934 8.028 -0.094 18755
351 1 1 . 1 1 72 72 GLN N N 72 118.200 118.200 116.290 1.910 18755
352 1 1 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.253 -0.218 18755
353 1 1 . 1 1 72 72 GLN C C 72 175.022 175.022 176.183 -1.161 18755
354 1 1 . 1 1 72 72 GLN CA C 72 57.210 57.210 55.231 1.979 18755
355 1 1 . 1 1 72 72 GLN CB C 72 27.880 27.880 30.202 -2.322 18755
356 1 1 . 1 1 72 72 GLN H H 72 8.051 8.051 7.919 0.132 18755
357 1 1 . 1 1 74 74 ILE N N 74 120.607 120.607 121.452 -0.845 18755
358 1 1 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.684 0.629 18755
359 1 1 . 1 1 74 74 ILE C C 74 174.400 174.400 175.084 -0.684 18755
360 1 1 . 1 1 74 74 ILE CA C 74 58.521 58.521 63.342 -4.821 18755
361 1 1 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.095 -0.853 18755
362 1 1 . 1 1 75 75 VAL N N 75 126.197 126.197 120.015 6.182 18755
363 1 1 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.186 -0.426 18755
364 1 1 . 1 1 75 75 VAL C C 75 174.100 174.100 173.912 0.188 18755
365 1 1 . 1 1 75 75 VAL CA C 75 60.538 60.538 59.526 1.012 18755
366 1 1 . 1 1 75 75 VAL CB C 75 31.759 31.759 34.716 -2.957 18755
367 1 1 . 1 1 75 75 VAL H H 75 8.274 8.274 7.516 0.758 18755
368 1 1 . 1 1 76 76 TYR N N 76 126.301 126.301 123.949 2.352 18755
369 1 1 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.570 -1.001 18755
370 1 1 . 1 1 76 76 TYR C C 76 175.000 175.000 175.889 -0.889 18755
371 1 1 . 1 1 76 76 TYR CA C 76 57.648 57.648 55.017 2.631 18755
372 1 1 . 1 1 76 76 TYR CB C 76 38.188 38.188 40.617 -2.429 18755
373 1 1 . 1 1 76 76 TYR H H 76 8.110 8.110 7.863 0.247 18755
374 1 1 . 1 1 77 77 CYS N N 77 117.781 117.781 120.571 -2.790 18755
375 1 1 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.848 -0.066 18755
376 1 1 . 1 1 77 77 CYS C C 77 173.429 173.429 174.221 -0.792 18755
377 1 1 . 1 1 77 77 CYS CA C 77 55.361 55.361 57.752 -2.391 18755
378 1 1 . 1 1 77 77 CYS CB C 77 29.255 29.255 28.715 0.540 18755
379 1 1 . 1 1 77 77 CYS H H 77 8.295 8.295 8.359 -0.064 18755
380 1 1 . 1 1 78 78 SER N N 78 116.896 116.896 120.849 -3.953 18755
381 1 1 . 1 1 78 78 SER HA H 78 4.182 4.182 4.703 -0.521 18755
382 1 1 . 1 1 78 78 SER CA C 78 60.064 60.064 58.660 1.405 18755
383 1 1 . 1 1 78 78 SER CB C 78 63.122 63.122 64.299 -1.177 18755
384 1 1 . 1 1 78 78 SER H H 78 7.585 7.585 8.617 -1.032 18755
385 1 1 . 1 1 79 79 ASN N N 79 118.100 118.100 120.761 -2.661 18755
386 1 1 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.922 -0.291 18755
387 1 1 . 1 1 79 79 ASN C C 79 172.700 172.700 173.592 -0.892 18755
388 1 1 . 1 1 79 79 ASN CA C 79 52.850 52.850 53.087 -0.237 18755
389 1 1 . 1 1 79 79 ASN CB C 79 37.796 37.796 39.248 -1.452 18755
390 1 1 . 1 1 79 79 ASN H H 79 8.609 8.609 8.396 0.213 18755
391 1 1 . 1 1 80 80 ASP N N 80 118.603 118.603 119.212 -0.609 18755
392 1 1 . 1 1 80 80 ASP HA H 80 4.774 4.774 5.029 -0.255 18755
393 1 1 . 1 1 80 80 ASP C C 80 174.900 174.900 177.048 -2.148 18755
394 1 1 . 1 1 80 80 ASP CA C 80 52.802 52.802 53.252 -0.450 18755
395 1 1 . 1 1 80 80 ASP CB C 80 47.221 47.221 44.354 2.867 18755
396 1 1 . 1 1 80 80 ASP H H 80 7.549 7.549 8.010 -0.461 18755
397 1 1 . 1 1 81 81 LEU N N 81 129.094 129.094 120.296 8.798 18755
398 1 1 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.429 -0.320 18755
399 1 1 . 1 1 81 81 LEU C C 81 177.800 177.800 177.636 0.164 18755
400 1 1 . 1 1 81 81 LEU CA C 81 57.666 57.666 57.253 0.413 18755
401 1 1 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.593 0.433 18755
402 1 1 . 1 1 81 81 LEU H H 81 8.411 8.411 9.072 -0.661 18755
403 1 1 . 1 1 82 82 LEU N N 82 118.601 118.601 121.310 -2.709 18755
404 1 1 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.206 -0.742 18755
405 1 1 . 1 1 82 82 LEU C C 82 178.100 178.100 177.912 0.188 18755
406 1 1 . 1 1 82 82 LEU CA C 82 57.811 57.811 55.858 1.953 18755
407 1 1 . 1 1 82 82 LEU CB C 82 42.416 42.416 41.143 1.273 18755
408 1 1 . 1 1 82 82 LEU H H 82 9.777 9.777 8.208 1.569 18755
409 1 1 . 1 1 83 83 GLY N N 83 105.800 105.800 105.567 0.233 18755
410 1 1 . 1 1 83 83 GLY C C 83 176.900 176.900 175.223 1.677 18755
411 1 1 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.414 1.140 18755
412 1 1 . 1 1 83 83 GLY H H 83 7.592 7.592 7.736 -0.144 18755
413 1 1 . 1 1 84 84 ASP N N 84 123.089 123.089 121.563 1.526 18755
414 1 1 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.454 -0.172 18755
415 1 1 . 1 1 84 84 ASP C C 84 178.600 178.600 177.325 1.275 18755
416 1 1 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.804 -0.224 18755
417 1 1 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.575 -0.680 18755
418 1 1 . 1 1 84 84 ASP H H 84 7.366 7.366 8.238 -0.872 18755
419 1 1 . 1 1 85 85 LEU N N 85 118.800 118.800 118.666 0.134 18755
420 1 1 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.925 0.062 18755
421 1 1 . 1 1 85 85 LEU C C 85 178.900 178.900 178.698 0.202 18755
422 1 1 . 1 1 85 85 LEU CA C 85 56.984 56.984 57.080 -0.096 18755
423 1 1 . 1 1 85 85 LEU CB C 85 41.221 41.221 41.722 -0.501 18755
424 1 1 . 1 1 85 85 LEU H H 85 7.981 7.981 7.257 0.724 18755
425 1 1 . 1 1 86 86 PHE N N 86 117.812 117.812 115.785 2.027 18755
426 1 1 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.298 0.104 18755
427 1 1 . 1 1 86 86 PHE C C 86 176.400 176.400 177.354 -0.954 18755
428 1 1 . 1 1 86 86 PHE CA C 86 55.833 55.833 59.606 -3.773 18755
429 1 1 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.306 -1.978 18755
430 1 1 . 1 1 86 86 PHE H H 86 8.531 8.531 7.447 1.084 18755
431 1 1 . 1 1 87 87 GLY N N 87 107.899 107.899 107.394 0.505 18755
432 1 1 . 1 1 87 87 GLY C C 87 173.800 173.800 173.997 -0.197 18755
433 1 1 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.712 0.175 18755
434 1 1 . 1 1 87 87 GLY H H 87 8.150 8.150 7.998 0.152 18755
435 1 1 . 1 1 88 88 VAL N N 88 108.596 108.596 114.639 -6.043 18755
436 1 1 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.788 0.109 18755
437 1 1 . 1 1 88 88 VAL C C 88 174.100 174.100 174.399 -0.299 18755
438 1 1 . 1 1 88 88 VAL CA C 88 56.703 56.703 57.903 -1.200 18755
439 1 1 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.155 1.644 18755
440 1 1 . 1 1 88 88 VAL H H 88 7.073 7.073 7.610 -0.537 18755
441 1 1 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.522 -0.180 18755
442 1 1 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.280 -1.400 18755
443 1 1 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.420 -0.800 18755
444 1 1 . 1 1 90 90 SER N N 90 110.799 110.799 113.426 -2.627 18755
445 1 1 . 1 1 90 90 SER HA H 90 5.362 5.362 5.218 0.144 18755
446 1 1 . 1 1 90 90 SER C C 90 172.300 172.300 173.474 -1.174 18755
447 1 1 . 1 1 90 90 SER CA C 90 56.470 56.470 56.507 -0.036 18755
448 1 1 . 1 1 90 90 SER CB C 90 64.481 64.481 65.586 -1.105 18755
449 1 1 . 1 1 90 90 SER H H 90 7.115 7.115 7.677 -0.562 18755
450 1 1 . 1 1 91 91 PHE N N 91 112.909 112.909 122.386 -9.477 18755
451 1 1 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.803 -0.042 18755
452 1 1 . 1 1 91 91 PHE C C 91 171.600 171.600 174.734 -3.134 18755
453 1 1 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.241 1.308 18755
454 1 1 . 1 1 91 91 PHE CB C 91 39.765 39.765 39.315 0.450 18755
455 1 1 . 1 1 91 91 PHE H H 91 8.008 8.008 8.026 -0.018 18755
456 1 1 . 1 1 92 92 SER N N 92 113.293 113.293 120.646 -7.353 18755
457 1 1 . 1 1 92 92 SER HA H 92 5.184 5.184 4.368 0.816 18755
458 1 1 . 1 1 92 92 SER C C 92 177.900 177.900 175.128 2.772 18755
459 1 1 . 1 1 92 92 SER CA C 92 55.256 55.256 58.133 -2.877 18755
460 1 1 . 1 1 92 92 SER CB C 92 63.592 63.592 62.442 1.150 18755
461 1 1 . 1 1 92 92 SER H H 92 8.708 8.708 8.883 -0.175 18755
462 1 1 . 1 1 93 93 VAL N N 93 121.309 121.309 127.458 -6.149 18755
463 1 1 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.732 0.574 18755
464 1 1 . 1 1 93 93 VAL C C 93 173.760 173.760 175.077 -1.317 18755
465 1 1 . 1 1 93 93 VAL CA C 93 63.973 63.973 65.071 -1.098 18755
466 1 1 . 1 1 93 93 VAL CB C 93 31.402 31.402 32.318 -0.916 18755
467 1 1 . 1 1 93 93 VAL H H 93 8.879 8.879 8.008 0.871 18755
468 1 1 . 1 1 94 94 LYS N N 94 113.118 113.118 113.093 0.025 18755
469 1 1 . 1 1 94 94 LYS HA H 94 4.380 4.380 4.143 0.237 18755
470 1 1 . 1 1 94 94 LYS C C 94 177.300 177.300 176.256 1.044 18755
471 1 1 . 1 1 94 94 LYS CA C 94 55.036 55.036 56.721 -1.685 18755
472 1 1 . 1 1 94 94 LYS CB C 94 32.231 32.231 32.284 -0.053 18755
473 1 1 . 1 1 94 94 LYS H H 94 7.836 7.836 7.788 0.048 18755
474 1 1 . 1 1 95 95 GLU N N 95 119.700 119.700 120.581 -0.881 18755
475 1 1 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.476 0.009 18755
476 1 1 . 1 1 95 95 GLU C C 95 176.100 176.100 176.477 -0.377 18755
477 1 1 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.724 -0.138 18755
478 1 1 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.902 0.040 18755
479 1 1 . 1 1 95 95 GLU H H 95 6.901 6.901 7.738 -0.837 18755
480 1 1 . 1 1 96 96 HIS N N 96 121.512 121.512 120.754 0.758 18755
481 1 1 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.154 0.203 18755
482 1 1 . 1 1 96 96 HIS C C 96 177.300 177.300 177.113 0.187 18755
483 1 1 . 1 1 96 96 HIS CA C 96 58.495 58.495 61.469 -2.974 18755
484 1 1 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.802 1.163 18755
485 1 1 . 1 1 96 96 HIS H H 96 7.568 7.568 6.739 0.829 18755
486 1 1 . 1 1 97 97 ARG N N 97 120.300 120.300 119.068 1.232 18755
487 1 1 . 1 1 97 97 ARG HA H 97 3.888 3.888 4.001 -0.113 18755
488 1 1 . 1 1 97 97 ARG C C 97 177.800 177.800 177.633 0.167 18755
489 1 1 . 1 1 97 97 ARG CA C 97 57.432 57.432 59.542 -2.110 18755
490 1 1 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.870 -4.020 18755
491 1 1 . 1 1 98 98 LYS N N 98 120.600 120.600 119.395 1.205 18755
492 1 1 . 1 1 98 98 LYS C C 98 178.500 178.500 179.368 -0.868 18755
493 1 1 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.506 0.564 18755
494 1 1 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.720 -0.900 18755
495 1 1 . 1 1 98 98 LYS H H 98 7.741 7.741 8.009 -0.268 18755
496 1 1 . 1 1 99 99 ILE N N 99 119.394 119.394 118.487 0.907 18755
497 1 1 . 1 1 99 99 ILE HA H 99 3.017 3.017 4.114 -1.097 18755
498 1 1 . 1 1 99 99 ILE C C 99 177.000 177.000 178.320 -1.320 18755
499 1 1 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.232 0.632 18755
500 1 1 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.663 0.021 18755
501 1 1 . 1 1 99 99 ILE H H 99 7.585 7.585 8.224 -0.639 18755
502 1 1 . 1 1 100 100 TYR N N 100 121.894 121.894 119.963 1.931 18755
503 1 1 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.283 -1.090 18755
504 1 1 . 1 1 100 100 TYR C C 100 176.500 176.500 178.440 -1.940 18755
505 1 1 . 1 1 100 100 TYR CA C 100 63.706 63.706 61.514 2.192 18755
506 1 1 . 1 1 100 100 TYR CB C 100 37.142 37.142 37.845 -0.703 18755
507 1 1 . 1 1 100 100 TYR H H 100 8.430 8.430 8.975 -0.545 18755
508 1 1 . 1 1 101 101 THR N N 101 113.693 113.693 115.003 -1.310 18755
509 1 1 . 1 1 101 101 THR HA H 101 3.805 3.805 4.113 -0.308 18755
510 1 1 . 1 1 101 101 THR C C 101 176.100 176.100 175.938 0.162 18755
511 1 1 . 1 1 101 101 THR CA C 101 67.003 67.003 66.462 0.541 18755
512 1 1 . 1 1 101 101 THR CB C 101 68.496 68.496 68.660 -0.164 18755
513 1 1 . 1 1 101 101 THR H H 101 8.232 8.232 7.921 0.311 18755
514 1 1 . 1 1 102 102 MET N N 102 119.500 119.500 117.930 1.570 18755
515 1 1 . 1 1 102 102 MET C C 102 178.000 178.000 178.852 -0.852 18755
516 1 1 . 1 1 102 102 MET CA C 102 59.360 59.360 56.599 2.761 18755
517 1 1 . 1 1 102 102 MET CB C 102 31.110 31.110 31.888 -0.778 18755
518 1 1 . 1 1 102 102 MET H H 102 7.461 7.461 7.878 -0.417 18755
519 1 1 . 1 1 103 103 ILE N N 103 120.103 120.103 120.003 0.100 18755
520 1 1 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.607 -0.444 18755
521 1 1 . 1 1 103 103 ILE C C 103 178.700 178.700 178.436 0.264 18755
522 1 1 . 1 1 103 103 ILE CA C 103 66.114 66.114 64.832 1.282 18755
523 1 1 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.552 -0.168 18755
524 1 1 . 1 1 103 103 ILE H H 103 7.824 7.824 7.909 -0.085 18755
525 1 1 . 1 1 104 104 TYR N N 104 119.500 119.500 118.304 1.196 18755
526 1 1 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.392 -0.326 18755
527 1 1 . 1 1 104 104 TYR C C 104 177.300 177.300 175.418 1.882 18755
528 1 1 . 1 1 104 104 TYR CA C 104 60.505 60.505 59.457 1.048 18755
529 1 1 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.749 -1.106 18755
530 1 1 . 1 1 104 104 TYR H H 104 8.694 8.694 8.658 0.036 18755
531 1 1 . 1 1 105 105 ARG N N 105 114.400 114.400 116.197 -1.797 18755
532 1 1 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.312 -0.075 18755
533 1 1 . 1 1 105 105 ARG C C 105 176.500 176.500 175.115 1.385 18755
534 1 1 . 1 1 105 105 ARG CA C 105 58.128 58.128 54.845 3.283 18755
535 1 1 . 1 1 105 105 ARG CB C 105 30.266 30.266 30.765 -0.499 18755
536 1 1 . 1 1 105 105 ARG H H 105 6.713 6.713 7.632 -0.919 18755
537 1 1 . 1 1 106 106 ASN N N 106 116.011 116.011 117.111 -1.100 18755
538 1 1 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.880 -0.046 18755
539 1 1 . 1 1 106 106 ASN C C 106 171.800 171.800 173.578 -1.778 18755
540 1 1 . 1 1 106 106 ASN CA C 106 53.484 53.484 52.968 0.516 18755
541 1 1 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.912 1.034 18755
542 1 1 . 1 1 106 106 ASN H H 106 8.396 8.396 7.594 0.802 18755
543 1 1 . 1 1 107 107 LEU N N 107 115.594 115.594 116.572 -0.978 18755
544 1 1 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.883 -0.104 18755
545 1 1 . 1 1 107 107 LEU C C 107 173.500 173.500 174.856 -1.356 18755
546 1 1 . 1 1 107 107 LEU CA C 107 54.230 54.230 53.010 1.220 18755
547 1 1 . 1 1 107 107 LEU CB C 107 45.490 45.490 44.028 1.462 18755
548 1 1 . 1 1 107 107 LEU H H 107 7.551 7.551 7.329 0.222 18755
549 1 1 . 1 1 108 108 VAL N N 108 117.493 117.493 121.726 -4.233 18755
550 1 1 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.305 0.009 18755
551 1 1 . 1 1 108 108 VAL C C 108 175.100 175.100 175.141 -0.041 18755
552 1 1 . 1 1 108 108 VAL CA C 108 60.620 60.620 60.898 -0.278 18755
553 1 1 . 1 1 108 108 VAL CB C 108 34.322 34.322 31.764 2.558 18755
554 1 1 . 1 1 108 108 VAL H H 108 7.906 7.906 8.607 -0.701 18755
555 1 1 . 1 1 109 109 VAL N N 109 128.100 128.100 124.059 4.041 18755
556 1 1 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.233 -0.254 18755
557 1 1 . 1 1 109 109 VAL C C 109 176.000 176.000 175.412 0.588 18755
558 1 1 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.689 0.630 18755
559 1 1 . 1 1 109 109 VAL CB C 109 31.909 31.909 32.024 -0.115 18755
560 1 1 . 1 1 109 109 VAL H H 109 8.740 8.740 8.498 0.242 18755
561 1 1 . 1 1 110 110 VAL N N 110 127.704 127.704 124.443 3.261 18755
562 1 1 . 1 1 110 110 VAL HA H 110 3.785 3.785 4.241 -0.456 18755
563 1 1 . 1 1 110 110 VAL C C 110 175.300 175.300 175.860 -0.560 18755
564 1 1 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.818 -0.928 18755
565 1 1 . 1 1 110 110 VAL H H 110 8.283 8.283 8.775 -0.492 18755
566 1 1 . 1 1 111 111 ASN N N 111 122.500 122.500 118.937 3.563 18755
567 1 1 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.838 -0.212 18755
568 1 1 . 1 1 111 111 ASN C C 111 174.728 174.728 173.928 0.800 18755
569 1 1 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.435 0.383 18755
570 1 1 . 1 1 111 111 ASN CB C 111 38.664 38.664 39.666 -1.002 18755
571 1 1 . 1 1 111 111 ASN H H 111 8.488 8.488 8.253 0.235 18755
572 1 1 . 1 1 112 112 GLN N N 112 121.700 121.700 120.439 1.261 18755
573 1 1 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.762 -0.568 18755
574 1 1 . 1 1 112 112 GLN C C 112 175.600 175.600 175.891 -0.291 18755
575 1 1 . 1 1 112 112 GLN CA C 112 55.958 55.958 55.162 0.796 18755
576 1 1 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.170 -1.195 18755
577 1 1 . 1 1 112 112 GLN H H 112 8.366 8.366 8.410 -0.044 18755
578 1 1 . 1 1 113 113 GLN N N 113 122.200 122.200 119.427 2.773 18755
579 1 1 . 1 1 113 113 GLN C C 113 176.200 176.200 175.539 0.661 18755
580 1 1 . 1 1 113 113 GLN CA C 113 56.500 56.500 57.047 -0.547 18755
581 1 1 . 1 1 113 113 GLN CB C 113 30.030 30.030 29.394 0.636 18755
582 1 1 . 1 1 113 113 GLN H H 113 8.331 8.331 8.601 -0.270 18755
583 1 1 . 1 1 115 115 SER N N 115 116.889 116.889 114.796 2.093 18755
584 1 1 . 1 1 115 115 SER HA H 115 4.392 4.392 4.708 -0.316 18755
585 1 1 . 1 1 115 115 SER C C 115 174.412 174.412 174.308 0.104 18755
586 1 1 . 1 1 115 115 SER CA C 115 57.837 57.837 58.048 -0.211 18755
587 1 1 . 1 1 115 115 SER CB C 115 63.574 63.574 63.681 -0.107 18755
588 1 1 . 1 1 115 115 SER H H 115 8.302 8.302 8.344 -0.042 18755
589 1 1 . 1 1 116 116 SER N N 116 118.000 118.000 119.393 -1.393 18755
590 1 1 . 1 1 116 116 SER HA H 116 4.381 4.381 4.712 -0.331 18755
591 1 1 . 1 1 116 116 SER C C 116 174.100 174.100 173.198 0.902 18755
592 1 1 . 1 1 116 116 SER CA C 116 58.062 58.062 57.666 0.396 18755
593 1 1 . 1 1 116 116 SER CB C 116 63.460 63.460 64.266 -0.806 18755
594 1 1 . 1 1 116 116 SER H H 116 8.350 8.350 8.427 -0.077 18755
595 1 1 . 1 1 117 117 ASP N N 117 122.400 122.400 120.944 1.456 18755
596 1 1 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.652 -0.101 18755
597 1 1 . 1 1 117 117 ASP C C 117 176.200 176.200 174.979 1.221 18755
598 1 1 . 1 1 117 117 ASP CA C 117 54.140 54.140 54.204 -0.064 18755
599 1 1 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.449 -0.469 18755
600 1 1 . 1 1 117 117 ASP H H 117 8.274 8.274 8.263 0.011 18755
601 1 1 . 1 1 118 118 SER N N 118 116.593 116.593 116.933 -0.340 18755
602 1 1 . 1 1 118 118 SER HA H 118 4.296 4.296 4.632 -0.336 18755
603 1 1 . 1 1 118 118 SER C C 118 175.000 175.000 174.566 0.434 18755
604 1 1 . 1 1 118 118 SER CA C 118 58.660 58.660 57.501 1.159 18755
605 1 1 . 1 1 118 118 SER CB C 118 63.550 63.550 63.743 -0.193 18755
606 1 1 . 1 1 118 118 SER H H 118 8.210 8.210 8.530 -0.320 18755
607 1 1 . 1 1 119 119 GLY N N 119 110.896 110.896 111.006 -0.110 18755
608 1 1 . 1 1 119 119 GLY C C 119 174.100 174.100 173.803 0.297 18755
609 1 1 . 1 1 119 119 GLY CA C 119 45.180 45.180 44.937 0.243 18755
610 1 1 . 1 1 119 119 GLY H H 119 8.376 8.376 8.225 0.151 18755
611 1 1 . 1 1 120 120 THR N N 120 113.503 113.503 113.124 0.379 18755
612 1 1 . 1 1 120 120 THR HA H 120 4.255 4.255 4.487 -0.232 18755
613 1 1 . 1 1 120 120 THR C C 120 174.385 174.385 173.676 0.709 18755
614 1 1 . 1 1 120 120 THR CA C 120 61.490 61.490 61.609 -0.119 18755
615 1 1 . 1 1 120 120 THR CB C 120 69.690 69.690 69.269 0.421 18755
616 1 1 . 1 1 120 120 THR H H 120 7.932 7.932 8.243 -0.311 18755
617 1 1 . 1 1 121 121 SER N N 121 118.800 118.800 123.097 -4.297 18755
618 1 1 . 1 1 121 121 SER HA H 121 4.354 4.354 4.747 -0.393 18755
619 1 1 . 1 1 121 121 SER C C 121 174.120 174.120 172.887 1.233 18755
620 1 1 . 1 1 121 121 SER CA C 121 57.876 57.876 57.497 0.379 18755
621 1 1 . 1 1 121 121 SER CB C 121 63.650 63.650 65.081 -1.431 18755
622 1 1 . 1 1 121 121 SER H H 121 8.284 8.284 8.482 -0.198 18755
623 1 1 . 1 1 122 122 VAL N N 122 121.801 121.801 118.355 3.446 18755
624 1 1 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.403 -0.333 18755
625 1 1 . 1 1 122 122 VAL C C 122 175.900 175.900 174.240 1.660 18755
626 1 1 . 1 1 122 122 VAL CA C 122 61.859 61.859 61.630 0.230 18755
627 1 1 . 1 1 122 122 VAL CB C 122 32.315 32.315 32.696 -0.381 18755
628 1 1 . 1 1 122 122 VAL H H 122 8.131 8.131 8.342 -0.211 18755
629 1 1 . 1 1 123 123 SER N N 123 119.593 119.593 121.620 -2.027 18755
630 1 1 . 1 1 123 123 SER HA H 123 4.331 4.331 4.687 -0.356 18755
631 1 1 . 1 1 123 123 SER C C 123 174.000 174.000 175.136 -1.136 18755
632 1 1 . 1 1 123 123 SER CA C 123 57.780 57.780 56.769 1.011 18755
633 1 1 . 1 1 123 123 SER CB C 123 63.720 63.720 65.326 -1.606 18755
634 1 1 . 1 1 123 123 SER H H 123 8.277 8.277 8.398 -0.121 18755
635 1 1 . 1 1 124 124 GLU N N 124 123.501 123.501 122.730 0.771 18755
636 1 1 . 1 1 124 124 GLU HA H 124 4.186 4.186 3.995 0.191 18755
637 1 1 . 1 1 124 124 GLU C C 124 175.060 175.060 176.288 -1.228 18755
638 1 1 . 1 1 124 124 GLU CA C 124 56.200 56.200 58.686 -2.486 18755
639 1 1 . 1 1 124 124 GLU CB C 124 30.270 30.270 29.808 0.462 18755
640 1 1 . 1 1 124 124 GLU H H 124 8.378 8.378 8.794 -0.416 18755
641 1 2 . 1 1 2 2 CYS N N 2 123.192 123.192 117.435 5.757 18755
642 1 2 . 1 1 2 2 CYS H H 2 8.252 8.252 8.825 -0.573 18755
643 1 2 . 1 1 3 3 ASN N N 3 123.749 123.749 118.746 5.003 18755
644 1 2 . 1 1 3 3 ASN H H 3 8.128 8.128 8.114 0.014 18755
645 1 2 . 1 1 6 6 MET N N 6 119.009 119.009 120.023 -1.014 18755
646 1 2 . 1 1 6 6 MET CA C 6 43.265 43.265 55.366 -12.101 18755
647 1 2 . 1 1 6 6 MET CB C 6 27.431 27.431 33.327 -5.896 18755
648 1 2 . 1 1 6 6 MET H H 6 7.099 7.099 8.023 -0.924 18755
649 1 2 . 1 1 7 7 SER N N 7 119.000 119.000 114.950 4.050 18755
650 1 2 . 1 1 7 7 SER HA H 7 4.337 4.337 4.921 -0.584 18755
651 1 2 . 1 1 7 7 SER C C 7 177.600 177.600 173.442 4.158 18755
652 1 2 . 1 1 7 7 SER CA C 7 57.850 57.850 57.370 0.480 18755
653 1 2 . 1 1 7 7 SER CB C 7 63.720 63.720 66.186 -2.466 18755
654 1 2 . 1 1 7 7 SER H H 7 8.246 8.246 7.923 0.323 18755
655 1 2 . 1 1 8 8 VAL N N 8 126.800 126.800 114.735 12.065 18755
656 1 2 . 1 1 8 8 VAL HA H 8 4.290 4.290 3.913 0.377 18755
657 1 2 . 1 1 8 8 VAL C C 8 180.600 180.600 173.965 6.635 18755
658 1 2 . 1 1 8 8 VAL CA C 8 55.790 55.790 63.212 -7.422 18755
659 1 2 . 1 1 8 8 VAL CB C 8 41.860 41.860 29.797 12.063 18755
660 1 2 . 1 1 8 8 VAL H H 8 7.988 7.988 8.338 -0.350 18755
661 1 2 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.829 -0.478 18755
662 1 2 . 1 1 9 9 PRO C C 9 176.757 176.757 176.611 0.146 18755
663 1 2 . 1 1 10 10 THR N N 10 113.463 113.463 113.113 0.350 18755
664 1 2 . 1 1 10 10 THR HA H 10 4.235 4.235 4.493 -0.258 18755
665 1 2 . 1 1 10 10 THR C C 10 174.000 174.000 175.571 -1.571 18755
666 1 2 . 1 1 10 10 THR CA C 10 61.265 61.265 63.728 -2.463 18755
667 1 2 . 1 1 10 10 THR CB C 10 69.466 69.466 69.152 0.314 18755
668 1 2 . 1 1 10 10 THR H H 10 8.109 8.109 8.346 -0.237 18755
669 1 2 . 1 1 11 11 ASP N N 11 122.009 122.009 121.288 0.721 18755
670 1 2 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.673 -0.250 18755
671 1 2 . 1 1 11 11 ASP C C 11 175.900 175.900 176.956 -1.056 18755
672 1 2 . 1 1 11 11 ASP CA C 11 54.245 54.245 54.632 -0.387 18755
673 1 2 . 1 1 11 11 ASP CB C 11 40.957 40.957 41.504 -0.547 18755
674 1 2 . 1 1 11 11 ASP H H 11 8.180 8.180 8.462 -0.282 18755
675 1 2 . 1 1 12 12 GLY N N 12 108.549 108.549 107.231 1.318 18755
676 1 2 . 1 1 12 12 GLY C C 12 171.700 171.700 172.417 -0.717 18755
677 1 2 . 1 1 12 12 GLY CA C 12 44.481 44.481 44.740 -0.259 18755
678 1 2 . 1 1 12 12 GLY H H 12 7.409 7.409 8.103 -0.694 18755
679 1 2 . 1 1 13 13 ALA N N 13 119.600 119.600 120.379 -0.779 18755
680 1 2 . 1 1 13 13 ALA HA H 13 4.302 4.302 4.157 0.145 18755
681 1 2 . 1 1 13 13 ALA C C 13 176.400 176.400 174.297 2.103 18755
682 1 2 . 1 1 13 13 ALA CA C 13 51.676 51.676 51.187 0.489 18755
683 1 2 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.164 0.482 18755
684 1 2 . 1 1 13 13 ALA H H 13 7.288 7.288 6.561 0.727 18755
685 1 2 . 1 1 14 14 VAL N N 14 118.098 118.098 118.818 -0.720 18755
686 1 2 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.429 0.119 18755
687 1 2 . 1 1 14 14 VAL C C 14 174.300 174.300 175.276 -0.976 18755
688 1 2 . 1 1 14 14 VAL CA C 14 60.637 60.637 60.437 0.200 18755
689 1 2 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.963 0.210 18755
690 1 2 . 1 1 14 14 VAL H H 14 8.091 8.091 8.599 -0.508 18755
691 1 2 . 1 1 15 15 THR N N 15 116.900 116.900 111.952 4.948 18755
692 1 2 . 1 1 15 15 THR HA H 15 4.750 4.750 4.555 0.195 18755
693 1 2 . 1 1 15 15 THR C C 15 173.364 173.364 173.434 -0.070 18755
694 1 2 . 1 1 15 15 THR CA C 15 60.011 60.011 61.044 -1.034 18755
695 1 2 . 1 1 15 15 THR CB C 15 71.125 71.125 70.632 0.493 18755
696 1 2 . 1 1 15 15 THR H H 15 8.303 8.303 8.252 0.051 18755
697 1 2 . 1 1 16 16 THR N N 16 116.004 116.004 116.047 -0.043 18755
698 1 2 . 1 1 16 16 THR HA H 16 4.678 4.678 4.078 0.600 18755
699 1 2 . 1 1 16 16 THR C C 16 173.665 173.665 173.681 -0.016 18755
700 1 2 . 1 1 16 16 THR CA C 16 57.028 57.028 60.926 -3.898 18755
701 1 2 . 1 1 16 16 THR CB C 16 67.263 67.263 71.060 -3.797 18755
702 1 2 . 1 1 16 16 THR H H 16 8.352 8.352 8.055 0.298 18755
703 1 2 . 1 1 17 17 SER N N 17 121.926 121.926 115.947 5.979 18755
704 1 2 . 1 1 17 17 SER HA H 17 4.440 4.440 4.719 -0.279 18755
705 1 2 . 1 1 17 17 SER CA C 17 58.639 58.639 59.738 -1.099 18755
706 1 2 . 1 1 17 17 SER CB C 17 63.087 63.087 64.675 -1.588 18755
707 1 2 . 1 1 17 17 SER H H 17 8.566 8.566 9.028 -0.462 18755
708 1 2 . 1 1 18 18 GLN N N 18 121.238 121.238 119.444 1.794 18755
709 1 2 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.428 -0.480 18755
710 1 2 . 1 1 18 18 GLN C C 18 174.237 174.237 174.672 -0.435 18755
711 1 2 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.053 0.432 18755
712 1 2 . 1 1 18 18 GLN CB C 18 29.687 29.687 30.267 -0.580 18755
713 1 2 . 1 1 18 18 GLN H H 18 9.115 9.115 8.627 0.488 18755
714 1 2 . 1 1 19 19 ILE N N 19 117.894 117.894 115.181 2.713 18755
715 1 2 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.517 -0.187 18755
716 1 2 . 1 1 19 19 ILE C C 19 173.200 173.200 172.977 0.223 18755
717 1 2 . 1 1 19 19 ILE CA C 19 54.716 54.716 59.287 -4.571 18755
718 1 2 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.160 1.898 18755
719 1 2 . 1 1 19 19 ILE H H 19 6.487 6.487 7.950 -1.463 18755
720 1 2 . 1 1 21 21 ALA N N 21 128.900 128.900 122.034 6.866 18755
721 1 2 . 1 1 21 21 ALA HA H 21 3.890 3.890 3.967 -0.077 18755
722 1 2 . 1 1 21 21 ALA C C 21 180.600 180.600 179.259 1.341 18755
723 1 2 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.032 0.876 18755
724 1 2 . 1 1 21 21 ALA CB C 21 17.767 17.767 18.317 -0.550 18755
725 1 2 . 1 1 21 21 ALA H H 21 8.867 8.867 8.732 0.135 18755
726 1 2 . 1 1 22 22 SER N N 22 111.315 111.315 112.142 -0.827 18755
727 1 2 . 1 1 22 22 SER HA H 22 3.787 3.787 4.144 -0.357 18755
728 1 2 . 1 1 22 22 SER C C 22 178.400 178.400 175.444 2.956 18755
729 1 2 . 1 1 22 22 SER CA C 22 61.138 61.138 60.485 0.653 18755
730 1 2 . 1 1 22 22 SER CB C 22 60.854 60.854 62.663 -1.809 18755
731 1 2 . 1 1 22 22 SER H H 22 8.752 8.752 8.190 0.562 18755
732 1 2 . 1 1 23 23 GLU N N 23 122.700 122.700 117.456 5.244 18755
733 1 2 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.432 -0.424 18755
734 1 2 . 1 1 23 23 GLU C C 23 179.100 179.100 176.376 2.724 18755
735 1 2 . 1 1 23 23 GLU CA C 23 58.515 58.515 56.304 2.211 18755
736 1 2 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.978 -1.620 18755
737 1 2 . 1 1 23 23 GLU H H 23 6.949 6.949 8.050 -1.101 18755
738 1 2 . 1 1 24 24 GLN N N 24 118.007 118.007 115.967 2.040 18755
739 1 2 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.591 -0.118 18755
740 1 2 . 1 1 24 24 GLN C C 24 175.200 175.200 175.277 -0.077 18755
741 1 2 . 1 1 24 24 GLN CA C 24 57.851 57.851 54.735 3.116 18755
742 1 2 . 1 1 24 24 GLN CB C 24 29.025 29.025 29.498 -0.473 18755
743 1 2 . 1 1 24 24 GLN H H 24 7.419 7.419 7.805 -0.386 18755
744 1 2 . 1 1 25 25 GLU N N 25 114.406 114.406 120.312 -5.906 18755
745 1 2 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.140 0.156 18755
746 1 2 . 1 1 25 25 GLU C C 25 175.500 175.500 175.892 -0.392 18755
747 1 2 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.679 -0.829 18755
748 1 2 . 1 1 25 25 GLU CB C 25 29.660 29.660 27.473 2.187 18755
749 1 2 . 1 1 25 25 GLU H H 25 7.148 7.148 8.050 -0.902 18755
750 1 2 . 1 1 26 26 THR N N 26 116.297 116.297 118.234 -1.937 18755
751 1 2 . 1 1 26 26 THR HA H 26 3.808 3.808 4.473 -0.665 18755
752 1 2 . 1 1 26 26 THR C C 26 172.700 172.700 173.611 -0.911 18755
753 1 2 . 1 1 26 26 THR CA C 26 64.750 64.750 61.630 3.120 18755
754 1 2 . 1 1 26 26 THR CB C 26 69.899 69.899 70.397 -0.498 18755
755 1 2 . 1 1 26 26 THR H H 26 7.178 7.178 7.639 -0.461 18755
756 1 2 . 1 1 27 27 LEU N N 27 128.394 128.394 129.867 -1.473 18755
757 1 2 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.308 0.466 18755
758 1 2 . 1 1 27 27 LEU C C 27 176.600 176.600 175.083 1.517 18755
759 1 2 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.816 -1.250 18755
760 1 2 . 1 1 27 27 LEU CB C 27 42.977 42.977 43.442 -0.465 18755
761 1 2 . 1 1 27 27 LEU H H 27 8.381 8.381 8.879 -0.498 18755
762 1 2 . 1 1 28 28 VAL N N 28 117.407 117.407 121.547 -4.140 18755
763 1 2 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.423 -0.315 18755
764 1 2 . 1 1 28 28 VAL C C 28 173.600 173.600 174.359 -0.759 18755
765 1 2 . 1 1 28 28 VAL CA C 28 58.968 58.968 59.025 -0.057 18755
766 1 2 . 1 1 28 28 VAL CB C 28 36.828 36.828 35.573 1.255 18755
767 1 2 . 1 1 28 28 VAL H H 28 9.682 9.682 8.944 0.738 18755
768 1 2 . 1 1 29 29 ARG N N 29 121.300 121.300 125.791 -4.491 18755
769 1 2 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.683 0.553 18755
770 1 2 . 1 1 29 29 ARG C C 29 174.700 174.700 173.992 0.708 18755
771 1 2 . 1 1 29 29 ARG CA C 29 52.103 52.103 52.553 -0.450 18755
772 1 2 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.348 0.771 18755
773 1 2 . 1 1 29 29 ARG H H 29 9.164 9.164 7.830 1.334 18755
774 1 2 . 1 1 33 33 LEU N N 33 118.497 118.497 119.118 -0.621 18755
775 1 2 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.294 -0.231 18755
776 1 2 . 1 1 33 33 LEU C C 33 178.140 178.140 178.683 -0.543 18755
777 1 2 . 1 1 33 33 LEU CA C 33 57.855 57.855 56.182 1.673 18755
778 1 2 . 1 1 33 33 LEU CB C 33 41.146 41.146 42.307 -1.161 18755
779 1 2 . 1 1 33 33 LEU H H 33 8.807 8.807 8.268 0.539 18755
780 1 2 . 1 1 34 34 LEU N N 34 118.106 118.106 120.830 -2.724 18755
781 1 2 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.932 -0.005 18755
782 1 2 . 1 1 34 34 LEU C C 34 177.700 177.700 178.750 -1.050 18755
783 1 2 . 1 1 34 34 LEU CA C 34 56.526 56.526 58.012 -1.486 18755
784 1 2 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.268 -0.867 18755
785 1 2 . 1 1 34 34 LEU H H 34 7.298 7.298 7.930 -0.632 18755
786 1 2 . 1 1 35 35 LEU N N 35 119.900 119.900 112.563 7.337 18755
787 1 2 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.253 -0.572 18755
788 1 2 . 1 1 35 35 LEU C C 35 177.500 177.500 178.830 -1.330 18755
789 1 2 . 1 1 35 35 LEU CA C 35 57.820 57.820 56.553 1.267 18755
790 1 2 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.244 1.013 18755
791 1 2 . 1 1 35 35 LEU H H 35 8.521 8.521 8.214 0.307 18755
792 1 2 . 1 1 36 36 LYS N N 36 118.000 118.000 120.084 -2.084 18755
793 1 2 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.101 -0.374 18755
794 1 2 . 1 1 36 36 LYS C C 36 179.100 179.100 178.119 0.981 18755
795 1 2 . 1 1 36 36 LYS CA C 36 59.338 59.338 58.885 0.453 18755
796 1 2 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.949 -1.037 18755
797 1 2 . 1 1 36 36 LYS H H 36 7.824 7.824 8.326 -0.502 18755
798 1 2 . 1 1 37 37 LEU N N 37 120.701 120.701 120.311 0.390 18755
799 1 2 . 1 1 37 37 LEU HA H 37 3.668 3.668 3.958 -0.290 18755
800 1 2 . 1 1 37 37 LEU C C 37 180.200 180.200 178.607 1.593 18755
801 1 2 . 1 1 37 37 LEU CA C 37 59.088 59.088 58.113 0.975 18755
802 1 2 . 1 1 37 37 LEU CB C 37 40.927 40.927 41.888 -0.961 18755
803 1 2 . 1 1 37 37 LEU H H 37 7.230 7.230 7.410 -0.180 18755
804 1 2 . 1 1 38 38 LEU N N 38 120.600 120.600 115.605 4.995 18755
805 1 2 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.781 -0.321 18755
806 1 2 . 1 1 38 38 LEU C C 38 178.900 178.900 178.605 0.295 18755
807 1 2 . 1 1 38 38 LEU CA C 38 57.802 57.802 57.905 -0.103 18755
808 1 2 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.703 -1.419 18755
809 1 2 . 1 1 38 38 LEU H H 38 8.124 8.124 7.626 0.498 18755
810 1 2 . 1 1 39 39 LYS N N 39 118.000 118.000 119.325 -1.325 18755
811 1 2 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.109 0.054 18755
812 1 2 . 1 1 39 39 LYS C C 39 180.108 180.108 177.661 2.447 18755
813 1 2 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.688 0.317 18755
814 1 2 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.267 -2.545 18755
815 1 2 . 1 1 39 39 LYS H H 39 8.678 8.678 7.645 1.033 18755
816 1 2 . 1 1 40 40 SER N N 40 116.993 116.993 112.170 4.823 18755
817 1 2 . 1 1 40 40 SER HA H 40 4.269 4.269 4.382 -0.113 18755
818 1 2 . 1 1 40 40 SER C C 40 175.000 175.000 175.882 -0.882 18755
819 1 2 . 1 1 40 40 SER CA C 40 61.287 61.287 60.142 1.145 18755
820 1 2 . 1 1 40 40 SER CB C 40 62.907 62.907 63.702 -0.794 18755
821 1 2 . 1 1 40 40 SER H H 40 7.763 7.763 7.976 -0.213 18755
822 1 2 . 1 1 41 41 VAL N N 41 112.903 112.903 117.050 -4.147 18755
823 1 2 . 1 1 41 41 VAL HA H 41 4.667 4.667 4.343 0.324 18755
824 1 2 . 1 1 41 41 VAL C C 41 175.300 175.300 177.037 -1.737 18755
825 1 2 . 1 1 41 41 VAL CA C 41 60.235 60.235 62.800 -2.565 18755
826 1 2 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.220 -1.605 18755
827 1 2 . 1 1 41 41 VAL H H 41 7.143 7.143 7.357 -0.214 18755
828 1 2 . 1 1 42 42 GLY N N 42 105.906 105.906 106.940 -1.034 18755
829 1 2 . 1 1 42 42 GLY C C 42 174.300 174.300 173.530 0.770 18755
830 1 2 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.912 0.220 18755
831 1 2 . 1 1 42 42 GLY H H 42 7.354 7.354 7.512 -0.158 18755
832 1 2 . 1 1 43 43 ALA N N 43 125.097 125.097 125.861 -0.764 18755
833 1 2 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.479 0.422 18755
834 1 2 . 1 1 43 43 ALA C C 43 177.900 177.900 176.964 0.936 18755
835 1 2 . 1 1 43 43 ALA CA C 43 53.000 53.000 51.959 1.041 18755
836 1 2 . 1 1 43 43 ALA CB C 43 18.064 18.064 17.014 1.050 18755
837 1 2 . 1 1 43 43 ALA H H 43 7.246 7.246 7.851 -0.605 18755
838 1 2 . 1 1 44 44 GLN N N 44 118.000 118.000 123.474 -5.474 18755
839 1 2 . 1 1 44 44 GLN H H 44 8.676 8.676 8.086 0.590 18755
840 1 2 . 1 1 45 45 LYS N N 45 117.985 117.985 122.484 -4.499 18755
841 1 2 . 1 1 45 45 LYS H H 45 7.247 7.247 8.051 -0.804 18755
842 1 2 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.307 0.154 18755
843 1 2 . 1 1 46 46 ASP CA C 46 55.323 55.323 55.942 -0.619 18755
844 1 2 . 1 1 47 47 THR N N 47 111.306 111.306 108.720 2.586 18755
845 1 2 . 1 1 47 47 THR HA H 47 4.921 4.921 4.443 0.478 18755
846 1 2 . 1 1 47 47 THR C C 47 171.900 171.900 172.793 -0.893 18755
847 1 2 . 1 1 47 47 THR CA C 47 60.259 60.259 60.706 -0.447 18755
848 1 2 . 1 1 47 47 THR CB C 47 71.478 71.478 71.565 -0.087 18755
849 1 2 . 1 1 47 47 THR H H 47 6.869 6.869 7.366 -0.497 18755
850 1 2 . 1 1 48 48 TYR N N 48 119.895 119.895 121.366 -1.471 18755
851 1 2 . 1 1 48 48 TYR HA H 48 4.722 4.722 5.144 -0.422 18755
852 1 2 . 1 1 48 48 TYR C C 48 175.700 175.700 176.092 -0.392 18755
853 1 2 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.488 1.478 18755
854 1 2 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.630 3.938 18755
855 1 2 . 1 1 48 48 TYR H H 48 8.614 8.614 8.543 0.071 18755
856 1 2 . 1 1 49 49 THR N N 49 110.720 110.720 112.940 -2.220 18755
857 1 2 . 1 1 49 49 THR HA H 49 5.318 5.318 4.935 0.383 18755
858 1 2 . 1 1 49 49 THR C C 49 178.400 178.400 176.006 2.394 18755
859 1 2 . 1 1 49 49 THR CA C 49 61.019 61.019 60.353 0.666 18755
860 1 2 . 1 1 49 49 THR CB C 49 71.104 71.104 70.973 0.131 18755
861 1 2 . 1 1 49 49 THR H H 49 8.761 8.761 8.720 0.041 18755
862 1 2 . 1 1 50 50 MET N N 50 121.906 121.906 122.207 -0.301 18755
863 1 2 . 1 1 50 50 MET HA H 50 4.196 4.196 4.072 0.124 18755
864 1 2 . 1 1 50 50 MET C C 50 178.300 178.300 177.556 0.744 18755
865 1 2 . 1 1 50 50 MET CA C 50 57.557 57.557 59.589 -2.032 18755
866 1 2 . 1 1 50 50 MET CB C 50 30.037 30.037 32.698 -2.661 18755
867 1 2 . 1 1 50 50 MET H H 50 7.901 7.901 9.106 -1.205 18755
868 1 2 . 1 1 51 51 LYS N N 51 115.600 115.600 119.027 -3.427 18755
869 1 2 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.415 -0.130 18755
870 1 2 . 1 1 51 51 LYS C C 51 179.100 179.100 178.834 0.266 18755
871 1 2 . 1 1 51 51 LYS CA C 51 59.322 59.322 58.550 0.772 18755
872 1 2 . 1 1 51 51 LYS CB C 51 32.140 32.140 31.916 0.224 18755
873 1 2 . 1 1 51 51 LYS H H 51 8.413 8.413 7.890 0.523 18755
874 1 2 . 1 1 52 52 GLU N N 52 120.906 120.906 120.346 0.560 18755
875 1 2 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.871 0.532 18755
876 1 2 . 1 1 52 52 GLU C C 52 178.200 178.200 178.037 0.163 18755
877 1 2 . 1 1 52 52 GLU CA C 52 58.778 58.778 58.791 -0.013 18755
878 1 2 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.675 2.115 18755
879 1 2 . 1 1 52 52 GLU H H 52 7.646 7.646 8.111 -0.465 18755
880 1 2 . 1 1 53 53 VAL N N 53 120.300 120.300 120.157 0.143 18755
881 1 2 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.797 -0.616 18755
882 1 2 . 1 1 53 53 VAL C C 53 177.500 177.500 177.999 -0.499 18755
883 1 2 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.911 0.514 18755
884 1 2 . 1 1 53 53 VAL CB C 53 30.360 30.360 31.066 -0.706 18755
885 1 2 . 1 1 53 53 VAL H H 53 7.972 7.972 8.475 -0.503 18755
886 1 2 . 1 1 54 54 LEU N N 54 120.594 120.594 117.300 3.294 18755
887 1 2 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.055 -0.371 18755
888 1 2 . 1 1 54 54 LEU C C 54 178.900 178.900 179.744 -0.844 18755
889 1 2 . 1 1 54 54 LEU CA C 54 55.110 55.110 56.874 -1.764 18755
890 1 2 . 1 1 54 54 LEU CB C 54 39.237 39.237 39.695 -0.458 18755
891 1 2 . 1 1 54 54 LEU H H 54 8.063 8.063 7.760 0.303 18755
892 1 2 . 1 1 55 55 PHE N N 55 120.300 120.300 121.116 -0.816 18755
893 1 2 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.062 -0.111 18755
894 1 2 . 1 1 55 55 PHE C C 55 177.900 177.900 176.737 1.163 18755
895 1 2 . 1 1 55 55 PHE CA C 55 61.017 61.017 61.760 -0.743 18755
896 1 2 . 1 1 55 55 PHE CB C 55 38.083 38.083 38.784 -0.701 18755
897 1 2 . 1 1 55 55 PHE H H 55 7.339 7.339 7.495 -0.156 18755
898 1 2 . 1 1 56 56 TYR N N 56 119.500 119.500 117.118 2.382 18755
899 1 2 . 1 1 56 56 TYR HA H 56 3.740 3.740 3.936 -0.196 18755
900 1 2 . 1 1 56 56 TYR C C 56 178.200 178.200 178.161 0.039 18755
901 1 2 . 1 1 56 56 TYR CA C 56 62.737 62.737 61.037 1.700 18755
902 1 2 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.308 1.561 18755
903 1 2 . 1 1 56 56 TYR H H 56 8.074 8.074 7.412 0.662 18755
904 1 2 . 1 1 57 57 LEU N N 57 119.895 119.895 119.655 0.240 18755
905 1 2 . 1 1 57 57 LEU HA H 57 3.858 3.858 3.935 -0.077 18755
906 1 2 . 1 1 57 57 LEU C C 57 178.800 178.800 179.717 -0.917 18755
907 1 2 . 1 1 57 57 LEU CA C 57 57.567 57.567 57.940 -0.373 18755
908 1 2 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.308 0.850 18755
909 1 2 . 1 1 57 57 LEU H H 57 8.628 8.628 8.151 0.477 18755
910 1 2 . 1 1 58 58 GLY N N 58 107.015 107.015 106.301 0.714 18755
911 1 2 . 1 1 58 58 GLY C C 58 175.028 175.028 176.024 -0.996 18755
912 1 2 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.992 0.111 18755
913 1 2 . 1 1 58 58 GLY H H 58 8.245 8.245 8.282 -0.037 18755
914 1 2 . 1 1 59 59 GLN N N 59 119.400 119.400 121.532 -2.132 18755
915 1 2 . 1 1 59 59 GLN HA H 59 3.793 3.793 3.957 -0.164 18755
916 1 2 . 1 1 59 59 GLN C C 59 178.900 178.900 177.357 1.543 18755
917 1 2 . 1 1 59 59 GLN CA C 59 58.023 58.023 58.394 -0.371 18755
918 1 2 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.354 0.529 18755
919 1 2 . 1 1 59 59 GLN H H 59 7.400 7.400 8.140 -0.740 18755
920 1 2 . 1 1 60 60 TYR N N 60 123.589 123.589 121.295 2.294 18755
921 1 2 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.084 -0.397 18755
922 1 2 . 1 1 60 60 TYR C C 60 175.700 175.700 177.559 -1.859 18755
923 1 2 . 1 1 60 60 TYR CA C 60 62.621 62.621 61.594 1.027 18755
924 1 2 . 1 1 60 60 TYR CB C 60 38.069 38.069 38.239 -0.170 18755
925 1 2 . 1 1 60 60 TYR H H 60 8.521 8.521 8.035 0.486 18755
926 1 2 . 1 1 61 61 ILE N N 61 118.996 118.996 118.411 0.585 18755
927 1 2 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.325 -0.200 18755
928 1 2 . 1 1 61 61 ILE C C 61 177.600 177.600 177.734 -0.134 18755
929 1 2 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.306 0.602 18755
930 1 2 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.458 0.635 18755
931 1 2 . 1 1 61 61 ILE H H 61 8.240 8.240 7.552 0.688 18755
932 1 2 . 1 1 62 62 MET N N 62 115.500 115.500 118.411 -2.911 18755
933 1 2 . 1 1 62 62 MET HA H 62 4.333 4.333 4.249 0.084 18755
934 1 2 . 1 1 62 62 MET C C 62 180.000 180.000 177.965 2.035 18755
935 1 2 . 1 1 62 62 MET CA C 62 57.270 57.270 58.698 -1.428 18755
936 1 2 . 1 1 62 62 MET CB C 62 30.961 30.961 32.904 -1.943 18755
937 1 2 . 1 1 62 62 MET H H 62 7.750 7.750 7.346 0.404 18755
938 1 2 . 1 1 63 63 THR N N 63 117.070 117.070 112.457 4.613 18755
939 1 2 . 1 1 63 63 THR HA H 63 3.865 3.865 4.164 -0.299 18755
940 1 2 . 1 1 63 63 THR C C 63 176.200 176.200 176.238 -0.038 18755
941 1 2 . 1 1 63 63 THR CA C 63 65.992 65.992 64.947 1.045 18755
942 1 2 . 1 1 63 63 THR CB C 63 68.857 68.857 69.256 -0.399 18755
943 1 2 . 1 1 63 63 THR H H 63 8.423 8.423 7.945 0.478 18755
944 1 2 . 1 1 64 64 LYS N N 64 118.512 118.512 119.327 -0.815 18755
945 1 2 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.256 -0.302 18755
946 1 2 . 1 1 64 64 LYS C C 64 174.500 174.500 176.088 -1.588 18755
947 1 2 . 1 1 64 64 LYS CA C 64 55.027 55.027 55.353 -0.326 18755
948 1 2 . 1 1 64 64 LYS CB C 64 30.673 30.673 32.534 -1.861 18755
949 1 2 . 1 1 64 64 LYS H H 64 7.678 7.678 7.957 -0.279 18755
950 1 2 . 1 1 65 65 ARG N N 65 115.400 115.400 116.004 -0.604 18755
951 1 2 . 1 1 65 65 ARG HA H 65 3.764 3.764 4.258 -0.494 18755
952 1 2 . 1 1 65 65 ARG C C 65 175.900 175.900 176.780 -0.880 18755
953 1 2 . 1 1 65 65 ARG CA C 65 56.475 56.475 56.923 -0.448 18755
954 1 2 . 1 1 65 65 ARG CB C 65 25.911 25.911 26.775 -0.864 18755
955 1 2 . 1 1 65 65 ARG H H 65 7.467 7.467 7.770 -0.303 18755
956 1 2 . 1 1 66 66 LEU N N 66 115.591 115.591 116.430 -0.839 18755
957 1 2 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.112 0.223 18755
958 1 2 . 1 1 66 66 LEU C C 66 175.400 175.400 177.423 -2.023 18755
959 1 2 . 1 1 66 66 LEU CA C 66 54.526 54.526 56.639 -2.113 18755
960 1 2 . 1 1 66 66 LEU CB C 66 41.682 41.682 42.152 -0.470 18755
961 1 2 . 1 1 66 66 LEU H H 66 7.612 7.612 7.352 0.260 18755
962 1 2 . 1 1 67 67 TYR N N 67 116.298 116.298 115.984 0.314 18755
963 1 2 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.441 0.310 18755
964 1 2 . 1 1 67 67 TYR C C 67 173.576 173.576 175.405 -1.829 18755
965 1 2 . 1 1 67 67 TYR CA C 67 55.334 55.334 55.264 0.070 18755
966 1 2 . 1 1 67 67 TYR CB C 67 40.410 40.410 37.219 3.191 18755
967 1 2 . 1 1 67 67 TYR H H 67 7.127 7.127 7.698 -0.571 18755
968 1 2 . 1 1 68 68 ASP N N 68 124.792 124.792 124.021 0.771 18755
969 1 2 . 1 1 68 68 ASP C C 68 175.741 175.741 175.271 0.470 18755
970 1 2 . 1 1 68 68 ASP CA C 68 53.209 53.209 54.153 -0.944 18755
971 1 2 . 1 1 68 68 ASP CB C 68 42.503 42.503 41.976 0.527 18755
972 1 2 . 1 1 68 68 ASP H H 68 8.205 8.205 8.855 -0.650 18755
973 1 2 . 1 1 69 69 GLU N N 69 123.507 123.507 120.921 2.586 18755
974 1 2 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.586 -0.789 18755
975 1 2 . 1 1 69 69 GLU C C 69 176.859 176.859 176.525 0.334 18755
976 1 2 . 1 1 69 69 GLU CA C 69 57.980 57.980 53.998 3.982 18755
977 1 2 . 1 1 69 69 GLU CB C 69 29.260 29.260 29.055 0.205 18755
978 1 2 . 1 1 69 69 GLU H H 69 8.440 8.440 8.341 0.099 18755
979 1 2 . 1 1 70 70 LYS N N 70 117.904 117.904 123.701 -5.797 18755
980 1 2 . 1 1 70 70 LYS HA H 70 4.325 4.325 3.984 0.341 18755
981 1 2 . 1 1 70 70 LYS C C 70 177.016 177.016 177.811 -0.795 18755
982 1 2 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.444 -1.404 18755
983 1 2 . 1 1 70 70 LYS CB C 70 32.090 32.090 32.026 0.064 18755
984 1 2 . 1 1 70 70 LYS H H 70 8.208 8.208 8.582 -0.374 18755
985 1 2 . 1 1 71 71 GLN N N 71 118.762 118.762 117.776 0.986 18755
986 1 2 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.025 0.300 18755
987 1 2 . 1 1 71 71 GLN C C 71 175.300 175.300 176.604 -1.304 18755
988 1 2 . 1 1 71 71 GLN CA C 71 54.920 54.920 57.736 -2.816 18755
989 1 2 . 1 1 71 71 GLN CB C 71 28.850 28.850 29.424 -0.574 18755
990 1 2 . 1 1 71 71 GLN H H 71 7.934 7.934 8.061 -0.127 18755
991 1 2 . 1 1 72 72 GLN N N 72 118.200 118.200 116.082 2.118 18755
992 1 2 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.246 -0.211 18755
993 1 2 . 1 1 72 72 GLN C C 72 175.022 175.022 174.596 0.426 18755
994 1 2 . 1 1 72 72 GLN CA C 72 57.210 57.210 53.924 3.286 18755
995 1 2 . 1 1 72 72 GLN CB C 72 27.880 27.880 31.522 -3.642 18755
996 1 2 . 1 1 72 72 GLN H H 72 8.051 8.051 7.689 0.362 18755
997 1 2 . 1 1 74 74 ILE N N 74 120.607 120.607 121.508 -0.901 18755
998 1 2 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.725 0.588 18755
999 1 2 . 1 1 74 74 ILE C C 74 174.400 174.400 174.628 -0.228 18755
1000 1 2 . 1 1 74 74 ILE CA C 74 58.521 58.521 62.569 -4.048 18755
1001 1 2 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.058 -0.816 18755
1002 1 2 . 1 1 75 75 VAL N N 75 126.197 126.197 122.618 3.579 18755
1003 1 2 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.567 -0.807 18755
1004 1 2 . 1 1 75 75 VAL C C 75 174.100 174.100 173.438 0.662 18755
1005 1 2 . 1 1 75 75 VAL CA C 75 60.538 60.538 59.164 1.374 18755
1006 1 2 . 1 1 75 75 VAL CB C 75 31.759 31.759 35.096 -3.337 18755
1007 1 2 . 1 1 75 75 VAL H H 75 8.274 8.274 7.397 0.877 18755
1008 1 2 . 1 1 76 76 TYR N N 76 126.301 126.301 124.862 1.439 18755
1009 1 2 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.423 -0.854 18755
1010 1 2 . 1 1 76 76 TYR C C 76 175.000 175.000 176.122 -1.122 18755
1011 1 2 . 1 1 76 76 TYR CA C 76 57.648 57.648 56.681 0.967 18755
1012 1 2 . 1 1 76 76 TYR CB C 76 38.188 38.188 41.717 -3.529 18755
1013 1 2 . 1 1 76 76 TYR H H 76 8.110 8.110 7.795 0.315 18755
1014 1 2 . 1 1 77 77 CYS N N 77 117.781 117.781 118.092 -0.311 18755
1015 1 2 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.709 0.073 18755
1016 1 2 . 1 1 77 77 CYS C C 77 173.429 173.429 174.176 -0.747 18755
1017 1 2 . 1 1 77 77 CYS CA C 77 55.361 55.361 58.876 -3.515 18755
1018 1 2 . 1 1 77 77 CYS CB C 77 29.255 29.255 30.791 -1.536 18755
1019 1 2 . 1 1 77 77 CYS H H 77 8.295 8.295 8.522 -0.227 18755
1020 1 2 . 1 1 78 78 SER N N 78 116.896 116.896 118.732 -1.836 18755
1021 1 2 . 1 1 78 78 SER HA H 78 4.182 4.182 4.684 -0.502 18755
1022 1 2 . 1 1 78 78 SER CA C 78 60.064 60.064 59.361 0.703 18755
1023 1 2 . 1 1 78 78 SER CB C 78 63.122 63.122 63.618 -0.496 18755
1024 1 2 . 1 1 78 78 SER H H 78 7.585 7.585 8.770 -1.185 18755
1025 1 2 . 1 1 79 79 ASN N N 79 118.100 118.100 118.122 -0.022 18755
1026 1 2 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.908 -0.277 18755
1027 1 2 . 1 1 79 79 ASN C C 79 172.700 172.700 173.555 -0.855 18755
1028 1 2 . 1 1 79 79 ASN CA C 79 52.850 52.850 53.154 -0.304 18755
1029 1 2 . 1 1 79 79 ASN CB C 79 37.796 37.796 39.678 -1.882 18755
1030 1 2 . 1 1 79 79 ASN H H 79 8.609 8.609 8.199 0.410 18755
1031 1 2 . 1 1 80 80 ASP N N 80 118.603 118.603 120.360 -1.757 18755
1032 1 2 . 1 1 80 80 ASP HA H 80 4.774 4.774 4.810 -0.036 18755
1033 1 2 . 1 1 80 80 ASP C C 80 174.900 174.900 177.975 -3.075 18755
1034 1 2 . 1 1 80 80 ASP CA C 80 52.802 52.802 53.506 -0.704 18755
1035 1 2 . 1 1 80 80 ASP CB C 80 47.221 47.221 41.985 5.236 18755
1036 1 2 . 1 1 80 80 ASP H H 80 7.549 7.549 7.685 -0.136 18755
1037 1 2 . 1 1 81 81 LEU N N 81 129.094 129.094 121.302 7.792 18755
1038 1 2 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.385 -0.276 18755
1039 1 2 . 1 1 81 81 LEU C C 81 177.800 177.800 177.551 0.249 18755
1040 1 2 . 1 1 81 81 LEU CA C 81 57.666 57.666 56.926 0.740 18755
1041 1 2 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.560 0.466 18755
1042 1 2 . 1 1 81 81 LEU H H 81 8.411 8.411 9.040 -0.629 18755
1043 1 2 . 1 1 82 82 LEU N N 82 118.601 118.601 121.443 -2.842 18755
1044 1 2 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.314 -0.850 18755
1045 1 2 . 1 1 82 82 LEU C C 82 178.100 178.100 178.051 0.049 18755
1046 1 2 . 1 1 82 82 LEU CA C 82 57.811 57.811 55.974 1.837 18755
1047 1 2 . 1 1 82 82 LEU CB C 82 42.416 42.416 41.161 1.255 18755
1048 1 2 . 1 1 82 82 LEU H H 82 9.777 9.777 8.304 1.473 18755
1049 1 2 . 1 1 83 83 GLY N N 83 105.800 105.800 105.354 0.446 18755
1050 1 2 . 1 1 83 83 GLY C C 83 176.900 176.900 175.760 1.140 18755
1051 1 2 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.346 1.208 18755
1052 1 2 . 1 1 83 83 GLY H H 83 7.592 7.592 7.795 -0.203 18755
1053 1 2 . 1 1 84 84 ASP N N 84 123.089 123.089 122.101 0.988 18755
1054 1 2 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.480 -0.198 18755
1055 1 2 . 1 1 84 84 ASP C C 84 178.600 178.600 177.265 1.335 18755
1056 1 2 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.794 -0.214 18755
1057 1 2 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.621 -0.726 18755
1058 1 2 . 1 1 84 84 ASP H H 84 7.366 7.366 8.303 -0.937 18755
1059 1 2 . 1 1 85 85 LEU N N 85 118.800 118.800 118.358 0.442 18755
1060 1 2 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.974 0.013 18755
1061 1 2 . 1 1 85 85 LEU C C 85 178.900 178.900 178.279 0.621 18755
1062 1 2 . 1 1 85 85 LEU CA C 85 56.984 56.984 56.889 0.095 18755
1063 1 2 . 1 1 85 85 LEU CB C 85 41.221 41.221 41.968 -0.747 18755
1064 1 2 . 1 1 85 85 LEU H H 85 7.981 7.981 7.373 0.608 18755
1065 1 2 . 1 1 86 86 PHE N N 86 117.812 117.812 115.720 2.092 18755
1066 1 2 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.278 0.124 18755
1067 1 2 . 1 1 86 86 PHE C C 86 176.400 176.400 177.279 -0.879 18755
1068 1 2 . 1 1 86 86 PHE CA C 86 55.833 55.833 59.270 -3.437 18755
1069 1 2 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.367 -2.039 18755
1070 1 2 . 1 1 86 86 PHE H H 86 8.531 8.531 7.631 0.900 18755
1071 1 2 . 1 1 87 87 GLY N N 87 107.899 107.899 107.490 0.409 18755
1072 1 2 . 1 1 87 87 GLY C C 87 173.800 173.800 174.076 -0.276 18755
1073 1 2 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.632 0.255 18755
1074 1 2 . 1 1 87 87 GLY H H 87 8.150 8.150 8.040 0.110 18755
1075 1 2 . 1 1 88 88 VAL N N 88 108.596 108.596 113.629 -5.033 18755
1076 1 2 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.817 0.080 18755
1077 1 2 . 1 1 88 88 VAL C C 88 174.100 174.100 174.268 -0.168 18755
1078 1 2 . 1 1 88 88 VAL CA C 88 56.703 56.703 58.184 -1.481 18755
1079 1 2 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.610 1.189 18755
1080 1 2 . 1 1 88 88 VAL H H 88 7.073 7.073 7.546 -0.473 18755
1081 1 2 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.535 -0.193 18755
1082 1 2 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.867 -1.987 18755
1083 1 2 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.003 -0.383 18755
1084 1 2 . 1 1 90 90 SER N N 90 110.799 110.799 114.169 -3.370 18755
1085 1 2 . 1 1 90 90 SER HA H 90 5.362 5.362 4.711 0.651 18755
1086 1 2 . 1 1 90 90 SER C C 90 172.300 172.300 173.104 -0.804 18755
1087 1 2 . 1 1 90 90 SER CA C 90 56.470 56.470 56.810 -0.340 18755
1088 1 2 . 1 1 90 90 SER CB C 90 64.481 64.481 64.978 -0.497 18755
1089 1 2 . 1 1 90 90 SER H H 90 7.115 7.115 7.582 -0.467 18755
1090 1 2 . 1 1 91 91 PHE N N 91 112.909 112.909 120.473 -7.564 18755
1091 1 2 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.824 -0.063 18755
1092 1 2 . 1 1 91 91 PHE C C 91 171.600 171.600 174.532 -2.932 18755
1093 1 2 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.638 0.911 18755
1094 1 2 . 1 1 91 91 PHE CB C 91 39.765 39.765 40.934 -1.169 18755
1095 1 2 . 1 1 91 91 PHE H H 91 8.008 8.008 7.640 0.368 18755
1096 1 2 . 1 1 92 92 SER N N 92 113.293 113.293 119.385 -6.092 18755
1097 1 2 . 1 1 92 92 SER HA H 92 5.184 5.184 4.498 0.686 18755
1098 1 2 . 1 1 92 92 SER C C 92 177.900 177.900 175.626 2.274 18755
1099 1 2 . 1 1 92 92 SER CA C 92 55.256 55.256 57.955 -2.699 18755
1100 1 2 . 1 1 92 92 SER CB C 92 63.592 63.592 62.103 1.489 18755
1101 1 2 . 1 1 92 92 SER H H 92 8.708 8.708 8.886 -0.178 18755
1102 1 2 . 1 1 93 93 VAL N N 93 121.309 121.309 123.964 -2.655 18755
1103 1 2 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.816 0.490 18755
1104 1 2 . 1 1 93 93 VAL C C 93 173.760 173.760 175.282 -1.522 18755
1105 1 2 . 1 1 93 93 VAL CA C 93 63.973 63.973 65.745 -1.772 18755
1106 1 2 . 1 1 93 93 VAL CB C 93 31.402 31.402 31.985 -0.583 18755
1107 1 2 . 1 1 93 93 VAL H H 93 8.879 8.879 8.020 0.859 18755
1108 1 2 . 1 1 94 94 LYS N N 94 113.118 113.118 112.856 0.262 18755
1109 1 2 . 1 1 94 94 LYS HA H 94 4.380 4.380 4.016 0.364 18755
1110 1 2 . 1 1 94 94 LYS C C 94 177.300 177.300 176.680 0.620 18755
1111 1 2 . 1 1 94 94 LYS CA C 94 55.036 55.036 57.027 -1.991 18755
1112 1 2 . 1 1 94 94 LYS CB C 94 32.231 32.231 31.891 0.340 18755
1113 1 2 . 1 1 94 94 LYS H H 94 7.836 7.836 8.178 -0.342 18755
1114 1 2 . 1 1 95 95 GLU N N 95 119.700 119.700 121.750 -2.050 18755
1115 1 2 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.454 0.031 18755
1116 1 2 . 1 1 95 95 GLU C C 95 176.100 176.100 176.321 -0.221 18755
1117 1 2 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.782 -0.196 18755
1118 1 2 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.754 0.188 18755
1119 1 2 . 1 1 95 95 GLU H H 95 6.901 6.901 7.985 -1.084 18755
1120 1 2 . 1 1 96 96 HIS N N 96 121.512 121.512 120.350 1.162 18755
1121 1 2 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.131 0.226 18755
1122 1 2 . 1 1 96 96 HIS C C 96 177.300 177.300 177.090 0.210 18755
1123 1 2 . 1 1 96 96 HIS CA C 96 58.495 58.495 60.731 -2.236 18755
1124 1 2 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.718 1.247 18755
1125 1 2 . 1 1 96 96 HIS H H 96 7.568 7.568 6.803 0.765 18755
1126 1 2 . 1 1 97 97 ARG N N 97 120.300 120.300 118.916 1.384 18755
1127 1 2 . 1 1 97 97 ARG HA H 97 3.888 3.888 4.025 -0.137 18755
1128 1 2 . 1 1 97 97 ARG C C 97 177.800 177.800 177.470 0.330 18755
1129 1 2 . 1 1 97 97 ARG CA C 97 57.432 57.432 59.261 -1.829 18755
1130 1 2 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.785 -3.935 18755
1131 1 2 . 1 1 98 98 LYS N N 98 120.600 120.600 119.714 0.886 18755
1132 1 2 . 1 1 98 98 LYS C C 98 178.500 178.500 179.156 -0.656 18755
1133 1 2 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.420 0.650 18755
1134 1 2 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.904 -1.084 18755
1135 1 2 . 1 1 98 98 LYS H H 98 7.741 7.741 8.107 -0.366 18755
1136 1 2 . 1 1 99 99 ILE N N 99 119.394 119.394 119.053 0.341 18755
1137 1 2 . 1 1 99 99 ILE HA H 99 3.017 3.017 3.904 -0.887 18755
1138 1 2 . 1 1 99 99 ILE C C 99 177.000 177.000 178.227 -1.227 18755
1139 1 2 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.290 0.574 18755
1140 1 2 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.522 0.162 18755
1141 1 2 . 1 1 99 99 ILE H H 99 7.585 7.585 7.863 -0.278 18755
1142 1 2 . 1 1 100 100 TYR N N 100 121.894 121.894 120.222 1.672 18755
1143 1 2 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.203 -1.010 18755
1144 1 2 . 1 1 100 100 TYR C C 100 176.500 176.500 178.302 -1.802 18755
1145 1 2 . 1 1 100 100 TYR CA C 100 63.706 63.706 62.365 1.341 18755
1146 1 2 . 1 1 100 100 TYR CB C 100 37.142 37.142 37.670 -0.528 18755
1147 1 2 . 1 1 100 100 TYR H H 100 8.430 8.430 8.842 -0.412 18755
1148 1 2 . 1 1 101 101 THR N N 101 113.693 113.693 113.252 0.441 18755
1149 1 2 . 1 1 101 101 THR HA H 101 3.805 3.805 4.239 -0.434 18755
1150 1 2 . 1 1 101 101 THR C C 101 176.100 176.100 175.744 0.356 18755
1151 1 2 . 1 1 101 101 THR CA C 101 67.003 67.003 66.908 0.095 18755
1152 1 2 . 1 1 101 101 THR CB C 101 68.496 68.496 68.542 -0.046 18755
1153 1 2 . 1 1 101 101 THR H H 101 8.232 8.232 8.284 -0.052 18755
1154 1 2 . 1 1 102 102 MET N N 102 119.500 119.500 118.045 1.455 18755
1155 1 2 . 1 1 102 102 MET C C 102 178.000 178.000 178.673 -0.673 18755
1156 1 2 . 1 1 102 102 MET CA C 102 59.360 59.360 57.253 2.107 18755
1157 1 2 . 1 1 102 102 MET CB C 102 31.110 31.110 32.056 -0.946 18755
1158 1 2 . 1 1 102 102 MET H H 102 7.461 7.461 7.601 -0.140 18755
1159 1 2 . 1 1 103 103 ILE N N 103 120.103 120.103 120.260 -0.157 18755
1160 1 2 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.526 -0.363 18755
1161 1 2 . 1 1 103 103 ILE C C 103 178.700 178.700 178.283 0.417 18755
1162 1 2 . 1 1 103 103 ILE CA C 103 66.114 66.114 65.016 1.098 18755
1163 1 2 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.500 -0.116 18755
1164 1 2 . 1 1 103 103 ILE H H 103 7.824 7.824 8.010 -0.186 18755
1165 1 2 . 1 1 104 104 TYR N N 104 119.500 119.500 118.142 1.358 18755
1166 1 2 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.333 -0.267 18755
1167 1 2 . 1 1 104 104 TYR C C 104 177.300 177.300 175.582 1.718 18755
1168 1 2 . 1 1 104 104 TYR CA C 104 60.505 60.505 59.958 0.547 18755
1169 1 2 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.576 -0.933 18755
1170 1 2 . 1 1 104 104 TYR H H 104 8.694 8.694 8.695 -0.001 18755
1171 1 2 . 1 1 105 105 ARG N N 105 114.400 114.400 117.209 -2.809 18755
1172 1 2 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.085 0.151 18755
1173 1 2 . 1 1 105 105 ARG C C 105 176.500 176.500 175.758 0.742 18755
1174 1 2 . 1 1 105 105 ARG CA C 105 58.128 58.128 55.378 2.750 18755
1175 1 2 . 1 1 105 105 ARG CB C 105 30.266 30.266 30.666 -0.400 18755
1176 1 2 . 1 1 105 105 ARG H H 105 6.713 6.713 7.485 -0.772 18755
1177 1 2 . 1 1 106 106 ASN N N 106 116.011 116.011 118.056 -2.045 18755
1178 1 2 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.777 0.057 18755
1179 1 2 . 1 1 106 106 ASN C C 106 171.800 171.800 173.480 -1.680 18755
1180 1 2 . 1 1 106 106 ASN CA C 106 53.484 53.484 52.839 0.645 18755
1181 1 2 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.465 1.481 18755
1182 1 2 . 1 1 106 106 ASN H H 106 8.396 8.396 7.955 0.441 18755
1183 1 2 . 1 1 107 107 LEU N N 107 115.594 115.594 116.271 -0.677 18755
1184 1 2 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.838 -0.059 18755
1185 1 2 . 1 1 107 107 LEU C C 107 173.500 173.500 174.799 -1.299 18755
1186 1 2 . 1 1 107 107 LEU CA C 107 54.230 54.230 52.847 1.383 18755
1187 1 2 . 1 1 107 107 LEU CB C 107 45.490 45.490 43.464 2.026 18755
1188 1 2 . 1 1 107 107 LEU H H 107 7.551 7.551 7.267 0.284 18755
1189 1 2 . 1 1 108 108 VAL N N 108 117.493 117.493 121.254 -3.761 18755
1190 1 2 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.336 -0.022 18755
1191 1 2 . 1 1 108 108 VAL C C 108 175.100 175.100 175.066 0.034 18755
1192 1 2 . 1 1 108 108 VAL CA C 108 60.620 60.620 61.371 -0.751 18755
1193 1 2 . 1 1 108 108 VAL CB C 108 34.322 34.322 30.901 3.421 18755
1194 1 2 . 1 1 108 108 VAL H H 108 7.906 7.906 8.530 -0.624 18755
1195 1 2 . 1 1 109 109 VAL N N 109 128.100 128.100 122.643 5.457 18755
1196 1 2 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.065 -0.086 18755
1197 1 2 . 1 1 109 109 VAL C C 109 176.000 176.000 175.973 0.027 18755
1198 1 2 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.909 0.410 18755
1199 1 2 . 1 1 109 109 VAL CB C 109 31.909 31.909 31.555 0.354 18755
1200 1 2 . 1 1 109 109 VAL H H 109 8.740 8.740 8.444 0.296 18755
1201 1 2 . 1 1 110 110 VAL N N 110 127.704 127.704 127.575 0.129 18755
1202 1 2 . 1 1 110 110 VAL HA H 110 3.785 3.785 3.910 -0.125 18755
1203 1 2 . 1 1 110 110 VAL C C 110 175.300 175.300 176.149 -0.849 18755
1204 1 2 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.087 -0.197 18755
1205 1 2 . 1 1 110 110 VAL H H 110 8.283 8.283 8.781 -0.498 18755
1206 1 2 . 1 1 111 111 ASN N N 111 122.500 122.500 116.694 5.806 18755
1207 1 2 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.991 -0.365 18755
1208 1 2 . 1 1 111 111 ASN C C 111 174.728 174.728 173.140 1.588 18755
1209 1 2 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.909 -0.091 18755
1210 1 2 . 1 1 111 111 ASN CB C 111 38.664 38.664 41.629 -2.965 18755
1211 1 2 . 1 1 111 111 ASN H H 111 8.488 8.488 8.198 0.290 18755
1212 1 2 . 1 1 112 112 GLN N N 112 121.700 121.700 119.911 1.789 18755
1213 1 2 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.679 -0.485 18755
1214 1 2 . 1 1 112 112 GLN C C 112 175.600 175.600 174.792 0.808 18755
1215 1 2 . 1 1 112 112 GLN CA C 112 55.958 55.958 54.930 1.028 18755
1216 1 2 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.462 -1.487 18755
1217 1 2 . 1 1 112 112 GLN H H 112 8.366 8.366 8.267 0.099 18755
1218 1 2 . 1 1 113 113 GLN N N 113 122.200 122.200 120.264 1.936 18755
1219 1 2 . 1 1 113 113 GLN C C 113 176.200 176.200 175.681 0.519 18755
1220 1 2 . 1 1 113 113 GLN CA C 113 56.500 56.500 55.517 0.983 18755
1221 1 2 . 1 1 113 113 GLN CB C 113 30.030 30.030 30.296 -0.266 18755
1222 1 2 . 1 1 113 113 GLN H H 113 8.331 8.331 8.593 -0.262 18755
1223 1 2 . 1 1 115 115 SER N N 115 116.889 116.889 114.592 2.297 18755
1224 1 2 . 1 1 115 115 SER HA H 115 4.392 4.392 4.735 -0.343 18755
1225 1 2 . 1 1 115 115 SER C C 115 174.412 174.412 173.939 0.473 18755
1226 1 2 . 1 1 115 115 SER CA C 115 57.837 57.837 58.186 -0.349 18755
1227 1 2 . 1 1 115 115 SER CB C 115 63.574 63.574 64.017 -0.443 18755
1228 1 2 . 1 1 115 115 SER H H 115 8.302 8.302 8.190 0.112 18755
1229 1 2 . 1 1 116 116 SER N N 116 118.000 118.000 115.735 2.265 18755
1230 1 2 . 1 1 116 116 SER HA H 116 4.381 4.381 4.634 -0.253 18755
1231 1 2 . 1 1 116 116 SER C C 116 174.100 174.100 172.285 1.815 18755
1232 1 2 . 1 1 116 116 SER CA C 116 58.062 58.062 57.442 0.620 18755
1233 1 2 . 1 1 116 116 SER CB C 116 63.460 63.460 64.769 -1.309 18755
1234 1 2 . 1 1 116 116 SER H H 116 8.350 8.350 7.652 0.698 18755
1235 1 2 . 1 1 117 117 ASP N N 117 122.400 122.400 121.759 0.641 18755
1236 1 2 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.956 -0.405 18755
1237 1 2 . 1 1 117 117 ASP C C 117 176.200 176.200 175.389 0.811 18755
1238 1 2 . 1 1 117 117 ASP CA C 117 54.140 54.140 54.051 0.089 18755
1239 1 2 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.232 -0.252 18755
1240 1 2 . 1 1 117 117 ASP H H 117 8.274 8.274 8.612 -0.338 18755
1241 1 2 . 1 1 118 118 SER N N 118 116.593 116.593 117.552 -0.959 18755
1242 1 2 . 1 1 118 118 SER HA H 118 4.296 4.296 4.617 -0.321 18755
1243 1 2 . 1 1 118 118 SER C C 118 175.000 175.000 174.647 0.353 18755
1244 1 2 . 1 1 118 118 SER CA C 118 58.660 58.660 58.556 0.104 18755
1245 1 2 . 1 1 118 118 SER CB C 118 63.550 63.550 64.564 -1.014 18755
1246 1 2 . 1 1 118 118 SER H H 118 8.210 8.210 8.914 -0.704 18755
1247 1 2 . 1 1 119 119 GLY N N 119 110.896 110.896 111.347 -0.451 18755
1248 1 2 . 1 1 119 119 GLY C C 119 174.100 174.100 173.916 0.184 18755
1249 1 2 . 1 1 119 119 GLY CA C 119 45.180 45.180 45.138 0.042 18755
1250 1 2 . 1 1 119 119 GLY H H 119 8.376 8.376 8.498 -0.122 18755
1251 1 2 . 1 1 120 120 THR N N 120 113.503 113.503 112.458 1.045 18755
1252 1 2 . 1 1 120 120 THR HA H 120 4.255 4.255 4.691 -0.436 18755
1253 1 2 . 1 1 120 120 THR C C 120 174.385 174.385 174.015 0.370 18755
1254 1 2 . 1 1 120 120 THR CA C 120 61.490 61.490 60.790 0.700 18755
1255 1 2 . 1 1 120 120 THR CB C 120 69.690 69.690 71.041 -1.351 18755
1256 1 2 . 1 1 120 120 THR H H 120 7.932 7.932 7.805 0.127 18755
1257 1 2 . 1 1 121 121 SER N N 121 118.800 118.800 114.945 3.855 18755
1258 1 2 . 1 1 121 121 SER HA H 121 4.354 4.354 4.774 -0.420 18755
1259 1 2 . 1 1 121 121 SER C C 121 174.120 174.120 173.884 0.236 18755
1260 1 2 . 1 1 121 121 SER CA C 121 57.876 57.876 57.342 0.534 18755
1261 1 2 . 1 1 121 121 SER CB C 121 63.650 63.650 64.265 -0.615 18755
1262 1 2 . 1 1 121 121 SER H H 121 8.284 8.284 8.205 0.079 18755
1263 1 2 . 1 1 122 122 VAL N N 122 121.801 121.801 120.807 0.994 18755
1264 1 2 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.540 -0.470 18755
1265 1 2 . 1 1 122 122 VAL C C 122 175.900 175.900 174.217 1.683 18755
1266 1 2 . 1 1 122 122 VAL CA C 122 61.859 61.859 60.996 0.863 18755
1267 1 2 . 1 1 122 122 VAL CB C 122 32.315 32.315 34.388 -2.072 18755
1268 1 2 . 1 1 122 122 VAL H H 122 8.131 8.131 9.107 -0.976 18755
1269 1 2 . 1 1 123 123 SER N N 123 119.593 119.593 120.619 -1.026 18755
1270 1 2 . 1 1 123 123 SER HA H 123 4.331 4.331 5.125 -0.794 18755
1271 1 2 . 1 1 123 123 SER C C 123 174.000 174.000 173.082 0.918 18755
1272 1 2 . 1 1 123 123 SER CA C 123 57.780 57.780 57.378 0.402 18755
1273 1 2 . 1 1 123 123 SER CB C 123 63.720 63.720 66.704 -2.984 18755
1274 1 2 . 1 1 123 123 SER H H 123 8.277 8.277 8.482 -0.205 18755
1275 1 2 . 1 1 124 124 GLU N N 124 123.501 123.501 120.488 3.013 18755
1276 1 2 . 1 1 124 124 GLU HA H 124 4.186 4.186 4.572 -0.386 18755
1277 1 2 . 1 1 124 124 GLU C C 124 175.060 175.060 175.312 -0.252 18755
1278 1 2 . 1 1 124 124 GLU CA C 124 56.200 56.200 55.298 0.902 18755
1279 1 2 . 1 1 124 124 GLU CB C 124 30.270 30.270 31.134 -0.864 18755
1280 1 2 . 1 1 124 124 GLU H H 124 8.378 8.378 8.818 -0.440 18755
1281 1 3 . 1 1 2 2 CYS N N 2 123.192 123.192 120.743 2.449 18755
1282 1 3 . 1 1 2 2 CYS H H 2 8.252 8.252 8.178 0.074 18755
1283 1 3 . 1 1 3 3 ASN N N 3 123.749 123.749 118.977 4.772 18755
1284 1 3 . 1 1 3 3 ASN H H 3 8.128 8.128 8.697 -0.569 18755
1285 1 3 . 1 1 6 6 MET N N 6 119.009 119.009 118.846 0.163 18755
1286 1 3 . 1 1 6 6 MET CA C 6 43.265 43.265 55.484 -12.219 18755
1287 1 3 . 1 1 6 6 MET CB C 6 27.431 27.431 34.348 -6.917 18755
1288 1 3 . 1 1 6 6 MET H H 6 7.099 7.099 8.375 -1.276 18755
1289 1 3 . 1 1 7 7 SER N N 7 119.000 119.000 114.788 4.212 18755
1290 1 3 . 1 1 7 7 SER HA H 7 4.337 4.337 4.659 -0.322 18755
1291 1 3 . 1 1 7 7 SER C C 7 177.600 177.600 173.281 4.319 18755
1292 1 3 . 1 1 7 7 SER CA C 7 57.850 57.850 57.394 0.456 18755
1293 1 3 . 1 1 7 7 SER CB C 7 63.720 63.720 64.931 -1.211 18755
1294 1 3 . 1 1 7 7 SER H H 7 8.246 8.246 7.788 0.458 18755
1295 1 3 . 1 1 8 8 VAL N N 8 126.800 126.800 122.395 4.405 18755
1296 1 3 . 1 1 8 8 VAL HA H 8 4.290 4.290 4.517 -0.227 18755
1297 1 3 . 1 1 8 8 VAL C C 8 180.600 180.600 175.257 5.343 18755
1298 1 3 . 1 1 8 8 VAL CA C 8 55.790 55.790 59.538 -3.748 18755
1299 1 3 . 1 1 8 8 VAL CB C 8 41.860 41.860 32.428 9.432 18755
1300 1 3 . 1 1 8 8 VAL H H 8 7.988 7.988 8.410 -0.422 18755
1301 1 3 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.714 -0.363 18755
1302 1 3 . 1 1 9 9 PRO C C 9 176.757 176.757 176.406 0.351 18755
1303 1 3 . 1 1 10 10 THR N N 10 113.463 113.463 111.812 1.651 18755
1304 1 3 . 1 1 10 10 THR HA H 10 4.235 4.235 4.430 -0.195 18755
1305 1 3 . 1 1 10 10 THR C C 10 174.000 174.000 174.683 -0.683 18755
1306 1 3 . 1 1 10 10 THR CA C 10 61.265 61.265 63.266 -2.001 18755
1307 1 3 . 1 1 10 10 THR CB C 10 69.466 69.466 69.092 0.374 18755
1308 1 3 . 1 1 10 10 THR H H 10 8.109 8.109 8.122 -0.013 18755
1309 1 3 . 1 1 11 11 ASP N N 11 122.009 122.009 121.658 0.351 18755
1310 1 3 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.620 -0.197 18755
1311 1 3 . 1 1 11 11 ASP C C 11 175.900 175.900 176.580 -0.680 18755
1312 1 3 . 1 1 11 11 ASP CA C 11 54.245 54.245 53.482 0.763 18755
1313 1 3 . 1 1 11 11 ASP CB C 11 40.957 40.957 40.514 0.443 18755
1314 1 3 . 1 1 11 11 ASP H H 11 8.180 8.180 8.013 0.167 18755
1315 1 3 . 1 1 12 12 GLY N N 12 108.549 108.549 108.767 -0.218 18755
1316 1 3 . 1 1 12 12 GLY C C 12 171.700 171.700 172.823 -1.123 18755
1317 1 3 . 1 1 12 12 GLY CA C 12 44.481 44.481 45.354 -0.873 18755
1318 1 3 . 1 1 12 12 GLY H H 12 7.409 7.409 7.879 -0.470 18755
1319 1 3 . 1 1 13 13 ALA N N 13 119.600 119.600 123.263 -3.663 18755
1320 1 3 . 1 1 13 13 ALA HA H 13 4.302 4.302 3.520 0.782 18755
1321 1 3 . 1 1 13 13 ALA C C 13 176.400 176.400 174.195 2.205 18755
1322 1 3 . 1 1 13 13 ALA CA C 13 51.676 51.676 50.190 1.486 18755
1323 1 3 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.683 -0.037 18755
1324 1 3 . 1 1 13 13 ALA H H 13 7.288 7.288 6.717 0.571 18755
1325 1 3 . 1 1 14 14 VAL N N 14 118.098 118.098 117.872 0.226 18755
1326 1 3 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.353 0.195 18755
1327 1 3 . 1 1 14 14 VAL C C 14 174.300 174.300 174.957 -0.657 18755
1328 1 3 . 1 1 14 14 VAL CA C 14 60.637 60.637 60.648 -0.011 18755
1329 1 3 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.046 1.127 18755
1330 1 3 . 1 1 14 14 VAL H H 14 8.091 8.091 8.414 -0.323 18755
1331 1 3 . 1 1 15 15 THR N N 15 116.900 116.900 116.664 0.236 18755
1332 1 3 . 1 1 15 15 THR HA H 15 4.750 4.750 4.620 0.130 18755
1333 1 3 . 1 1 15 15 THR C C 15 173.364 173.364 173.506 -0.142 18755
1334 1 3 . 1 1 15 15 THR CA C 15 60.011 60.011 61.301 -1.290 18755
1335 1 3 . 1 1 15 15 THR CB C 15 71.125 71.125 70.636 0.489 18755
1336 1 3 . 1 1 15 15 THR H H 15 8.303 8.303 8.382 -0.079 18755
1337 1 3 . 1 1 16 16 THR N N 16 116.004 116.004 117.674 -1.670 18755
1338 1 3 . 1 1 16 16 THR HA H 16 4.678 4.678 4.132 0.546 18755
1339 1 3 . 1 1 16 16 THR C C 16 173.665 173.665 173.428 0.237 18755
1340 1 3 . 1 1 16 16 THR CA C 16 57.028 57.028 60.764 -3.736 18755
1341 1 3 . 1 1 16 16 THR CB C 16 67.263 67.263 71.766 -4.503 18755
1342 1 3 . 1 1 16 16 THR H H 16 8.352 8.352 8.199 0.153 18755
1343 1 3 . 1 1 17 17 SER N N 17 121.926 121.926 116.384 5.542 18755
1344 1 3 . 1 1 17 17 SER HA H 17 4.440 4.440 4.701 -0.261 18755
1345 1 3 . 1 1 17 17 SER CA C 17 58.639 58.639 59.331 -0.692 18755
1346 1 3 . 1 1 17 17 SER CB C 17 63.087 63.087 64.642 -1.555 18755
1347 1 3 . 1 1 17 17 SER H H 17 8.566 8.566 8.872 -0.306 18755
1348 1 3 . 1 1 18 18 GLN N N 18 121.238 121.238 118.800 2.438 18755
1349 1 3 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.396 -0.448 18755
1350 1 3 . 1 1 18 18 GLN C C 18 174.237 174.237 174.744 -0.507 18755
1351 1 3 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.670 -0.185 18755
1352 1 3 . 1 1 18 18 GLN CB C 18 29.687 29.687 30.339 -0.652 18755
1353 1 3 . 1 1 18 18 GLN H H 18 9.115 9.115 8.736 0.379 18755
1354 1 3 . 1 1 19 19 ILE N N 19 117.894 117.894 115.677 2.217 18755
1355 1 3 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.482 -0.152 18755
1356 1 3 . 1 1 19 19 ILE C C 19 173.200 173.200 172.657 0.543 18755
1357 1 3 . 1 1 19 19 ILE CA C 19 54.716 54.716 58.033 -3.317 18755
1358 1 3 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.683 1.375 18755
1359 1 3 . 1 1 19 19 ILE H H 19 6.487 6.487 7.836 -1.349 18755
1360 1 3 . 1 1 21 21 ALA N N 21 128.900 128.900 121.505 7.395 18755
1361 1 3 . 1 1 21 21 ALA HA H 21 3.890 3.890 3.885 0.005 18755
1362 1 3 . 1 1 21 21 ALA C C 21 180.600 180.600 179.112 1.488 18755
1363 1 3 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.498 0.410 18755
1364 1 3 . 1 1 21 21 ALA CB C 21 17.767 17.767 17.812 -0.045 18755
1365 1 3 . 1 1 21 21 ALA H H 21 8.867 8.867 8.762 0.105 18755
1366 1 3 . 1 1 22 22 SER N N 22 111.315 111.315 110.718 0.597 18755
1367 1 3 . 1 1 22 22 SER HA H 22 3.787 3.787 4.070 -0.283 18755
1368 1 3 . 1 1 22 22 SER C C 22 178.400 178.400 175.504 2.896 18755
1369 1 3 . 1 1 22 22 SER CA C 22 61.138 61.138 61.140 -0.002 18755
1370 1 3 . 1 1 22 22 SER CB C 22 60.854 60.854 62.453 -1.599 18755
1371 1 3 . 1 1 22 22 SER H H 22 8.752 8.752 8.617 0.135 18755
1372 1 3 . 1 1 23 23 GLU N N 23 122.700 122.700 116.357 6.343 18755
1373 1 3 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.318 -0.310 18755
1374 1 3 . 1 1 23 23 GLU C C 23 179.100 179.100 177.394 1.706 18755
1375 1 3 . 1 1 23 23 GLU CA C 23 58.515 58.515 57.189 1.326 18755
1376 1 3 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.382 -1.024 18755
1377 1 3 . 1 1 23 23 GLU H H 23 6.949 6.949 7.440 -0.491 18755
1378 1 3 . 1 1 24 24 GLN N N 24 118.007 118.007 116.333 1.674 18755
1379 1 3 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.482 -0.009 18755
1380 1 3 . 1 1 24 24 GLN C C 24 175.200 175.200 176.337 -1.137 18755
1381 1 3 . 1 1 24 24 GLN CA C 24 57.851 57.851 54.452 3.399 18755
1382 1 3 . 1 1 24 24 GLN CB C 24 29.025 29.025 28.648 0.377 18755
1383 1 3 . 1 1 24 24 GLN H H 24 7.419 7.419 7.889 -0.470 18755
1384 1 3 . 1 1 25 25 GLU N N 25 114.406 114.406 123.087 -8.681 18755
1385 1 3 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.311 -0.015 18755
1386 1 3 . 1 1 25 25 GLU C C 25 175.500 175.500 175.226 0.274 18755
1387 1 3 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.711 -0.861 18755
1388 1 3 . 1 1 25 25 GLU CB C 25 29.660 29.660 28.117 1.543 18755
1389 1 3 . 1 1 25 25 GLU H H 25 7.148 7.148 8.492 -1.344 18755
1390 1 3 . 1 1 26 26 THR N N 26 116.297 116.297 116.703 -0.406 18755
1391 1 3 . 1 1 26 26 THR HA H 26 3.808 3.808 4.586 -0.778 18755
1392 1 3 . 1 1 26 26 THR C C 26 172.700 172.700 173.252 -0.552 18755
1393 1 3 . 1 1 26 26 THR CA C 26 64.750 64.750 61.411 3.339 18755
1394 1 3 . 1 1 26 26 THR CB C 26 69.899 69.899 70.051 -0.152 18755
1395 1 3 . 1 1 26 26 THR H H 26 7.178 7.178 8.216 -1.038 18755
1396 1 3 . 1 1 27 27 LEU N N 27 128.394 128.394 129.990 -1.596 18755
1397 1 3 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.253 0.521 18755
1398 1 3 . 1 1 27 27 LEU C C 27 176.600 176.600 175.093 1.507 18755
1399 1 3 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.858 -1.292 18755
1400 1 3 . 1 1 27 27 LEU CB C 27 42.977 42.977 42.972 0.005 18755
1401 1 3 . 1 1 27 27 LEU H H 27 8.381 8.381 8.981 -0.600 18755
1402 1 3 . 1 1 28 28 VAL N N 28 117.407 117.407 121.854 -4.447 18755
1403 1 3 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.423 -0.315 18755
1404 1 3 . 1 1 28 28 VAL C C 28 173.600 173.600 174.475 -0.875 18755
1405 1 3 . 1 1 28 28 VAL CA C 28 58.968 58.968 59.083 -0.115 18755
1406 1 3 . 1 1 28 28 VAL CB C 28 36.828 36.828 35.673 1.155 18755
1407 1 3 . 1 1 28 28 VAL H H 28 9.682 9.682 8.861 0.821 18755
1408 1 3 . 1 1 29 29 ARG N N 29 121.300 121.300 123.949 -2.649 18755
1409 1 3 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.710 0.526 18755
1410 1 3 . 1 1 29 29 ARG C C 29 174.700 174.700 173.988 0.712 18755
1411 1 3 . 1 1 29 29 ARG CA C 29 52.103 52.103 52.927 -0.824 18755
1412 1 3 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.180 0.939 18755
1413 1 3 . 1 1 29 29 ARG H H 29 9.164 9.164 8.144 1.020 18755
1414 1 3 . 1 1 33 33 LEU N N 33 118.497 118.497 121.150 -2.653 18755
1415 1 3 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.181 -0.118 18755
1416 1 3 . 1 1 33 33 LEU C C 33 178.140 178.140 178.444 -0.304 18755
1417 1 3 . 1 1 33 33 LEU CA C 33 57.855 57.855 57.290 0.565 18755
1418 1 3 . 1 1 33 33 LEU CB C 33 41.146 41.146 41.594 -0.448 18755
1419 1 3 . 1 1 33 33 LEU H H 33 8.807 8.807 8.464 0.343 18755
1420 1 3 . 1 1 34 34 LEU N N 34 118.106 118.106 120.573 -2.467 18755
1421 1 3 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.945 -0.018 18755
1422 1 3 . 1 1 34 34 LEU C C 34 177.700 177.700 178.873 -1.173 18755
1423 1 3 . 1 1 34 34 LEU CA C 34 56.526 56.526 58.084 -1.558 18755
1424 1 3 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.200 -0.798 18755
1425 1 3 . 1 1 34 34 LEU H H 34 7.298 7.298 7.673 -0.375 18755
1426 1 3 . 1 1 35 35 LEU N N 35 119.900 119.900 112.862 7.038 18755
1427 1 3 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.226 -0.544 18755
1428 1 3 . 1 1 35 35 LEU C C 35 177.500 177.500 178.950 -1.450 18755
1429 1 3 . 1 1 35 35 LEU CA C 35 57.820 57.820 56.924 0.896 18755
1430 1 3 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.345 0.912 18755
1431 1 3 . 1 1 35 35 LEU H H 35 8.521 8.521 8.303 0.218 18755
1432 1 3 . 1 1 36 36 LYS N N 36 118.000 118.000 119.477 -1.477 18755
1433 1 3 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.144 -0.417 18755
1434 1 3 . 1 1 36 36 LYS C C 36 179.100 179.100 178.602 0.498 18755
1435 1 3 . 1 1 36 36 LYS CA C 36 59.338 59.338 58.822 0.516 18755
1436 1 3 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.854 -0.942 18755
1437 1 3 . 1 1 36 36 LYS H H 36 7.824 7.824 8.260 -0.436 18755
1438 1 3 . 1 1 37 37 LEU N N 37 120.701 120.701 121.066 -0.365 18755
1439 1 3 . 1 1 37 37 LEU HA H 37 3.668 3.668 4.202 -0.534 18755
1440 1 3 . 1 1 37 37 LEU C C 37 180.200 180.200 178.399 1.801 18755
1441 1 3 . 1 1 37 37 LEU CA C 37 59.088 59.088 57.868 1.220 18755
1442 1 3 . 1 1 37 37 LEU CB C 37 40.927 40.927 41.260 -0.333 18755
1443 1 3 . 1 1 37 37 LEU H H 37 7.230 7.230 7.613 -0.383 18755
1444 1 3 . 1 1 38 38 LEU N N 38 120.600 120.600 116.441 4.159 18755
1445 1 3 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.951 -0.491 18755
1446 1 3 . 1 1 38 38 LEU C C 38 178.900 178.900 178.855 0.045 18755
1447 1 3 . 1 1 38 38 LEU CA C 38 57.802 57.802 58.106 -0.304 18755
1448 1 3 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.515 -1.231 18755
1449 1 3 . 1 1 38 38 LEU H H 38 8.124 8.124 7.666 0.458 18755
1450 1 3 . 1 1 39 39 LYS N N 39 118.000 118.000 119.293 -1.293 18755
1451 1 3 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.051 0.112 18755
1452 1 3 . 1 1 39 39 LYS C C 39 180.108 180.108 177.887 2.221 18755
1453 1 3 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.874 0.131 18755
1454 1 3 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.274 -2.552 18755
1455 1 3 . 1 1 39 39 LYS H H 39 8.678 8.678 7.650 1.028 18755
1456 1 3 . 1 1 40 40 SER N N 40 116.993 116.993 112.510 4.483 18755
1457 1 3 . 1 1 40 40 SER HA H 40 4.269 4.269 4.281 -0.012 18755
1458 1 3 . 1 1 40 40 SER C C 40 175.000 175.000 176.023 -1.023 18755
1459 1 3 . 1 1 40 40 SER CA C 40 61.287 61.287 60.516 0.771 18755
1460 1 3 . 1 1 40 40 SER CB C 40 62.907 62.907 63.412 -0.505 18755
1461 1 3 . 1 1 40 40 SER H H 40 7.763 7.763 7.889 -0.126 18755
1462 1 3 . 1 1 41 41 VAL N N 41 112.903 112.903 117.555 -4.652 18755
1463 1 3 . 1 1 41 41 VAL HA H 41 4.667 4.667 4.010 0.657 18755
1464 1 3 . 1 1 41 41 VAL C C 41 175.300 175.300 176.491 -1.191 18755
1465 1 3 . 1 1 41 41 VAL CA C 41 60.235 60.235 62.410 -2.175 18755
1466 1 3 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.749 -2.134 18755
1467 1 3 . 1 1 41 41 VAL H H 41 7.143 7.143 7.436 -0.293 18755
1468 1 3 . 1 1 42 42 GLY N N 42 105.906 105.906 105.486 0.420 18755
1469 1 3 . 1 1 42 42 GLY C C 42 174.300 174.300 173.410 0.890 18755
1470 1 3 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.882 0.250 18755
1471 1 3 . 1 1 42 42 GLY H H 42 7.354 7.354 7.384 -0.030 18755
1472 1 3 . 1 1 43 43 ALA N N 43 125.097 125.097 126.027 -0.930 18755
1473 1 3 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.415 0.486 18755
1474 1 3 . 1 1 43 43 ALA C C 43 177.900 177.900 177.175 0.725 18755
1475 1 3 . 1 1 43 43 ALA CA C 43 53.000 53.000 51.872 1.128 18755
1476 1 3 . 1 1 43 43 ALA CB C 43 18.064 18.064 16.958 1.106 18755
1477 1 3 . 1 1 43 43 ALA H H 43 7.246 7.246 7.842 -0.596 18755
1478 1 3 . 1 1 44 44 GLN N N 44 118.000 118.000 123.181 -5.181 18755
1479 1 3 . 1 1 44 44 GLN H H 44 8.676 8.676 8.056 0.620 18755
1480 1 3 . 1 1 45 45 LYS N N 45 117.985 117.985 121.910 -3.925 18755
1481 1 3 . 1 1 45 45 LYS H H 45 7.247 7.247 8.140 -0.893 18755
1482 1 3 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.333 0.128 18755
1483 1 3 . 1 1 46 46 ASP CA C 46 55.323 55.323 55.974 -0.651 18755
1484 1 3 . 1 1 47 47 THR N N 47 111.306 111.306 108.265 3.041 18755
1485 1 3 . 1 1 47 47 THR HA H 47 4.921 4.921 4.376 0.545 18755
1486 1 3 . 1 1 47 47 THR C C 47 171.900 171.900 172.762 -0.862 18755
1487 1 3 . 1 1 47 47 THR CA C 47 60.259 60.259 60.619 -0.360 18755
1488 1 3 . 1 1 47 47 THR CB C 47 71.478 71.478 70.937 0.541 18755
1489 1 3 . 1 1 47 47 THR H H 47 6.869 6.869 7.311 -0.442 18755
1490 1 3 . 1 1 48 48 TYR N N 48 119.895 119.895 120.529 -0.634 18755
1491 1 3 . 1 1 48 48 TYR HA H 48 4.722 4.722 5.258 -0.536 18755
1492 1 3 . 1 1 48 48 TYR C C 48 175.700 175.700 176.021 -0.321 18755
1493 1 3 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.460 1.506 18755
1494 1 3 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.877 3.690 18755
1495 1 3 . 1 1 48 48 TYR H H 48 8.614 8.614 8.385 0.229 18755
1496 1 3 . 1 1 49 49 THR N N 49 110.720 110.720 113.021 -2.301 18755
1497 1 3 . 1 1 49 49 THR HA H 49 5.318 5.318 4.861 0.457 18755
1498 1 3 . 1 1 49 49 THR C C 49 178.400 178.400 175.938 2.462 18755
1499 1 3 . 1 1 49 49 THR CA C 49 61.019 61.019 60.501 0.518 18755
1500 1 3 . 1 1 49 49 THR CB C 49 71.104 71.104 70.916 0.188 18755
1501 1 3 . 1 1 49 49 THR H H 49 8.761 8.761 8.757 0.004 18755
1502 1 3 . 1 1 50 50 MET N N 50 121.906 121.906 121.347 0.559 18755
1503 1 3 . 1 1 50 50 MET HA H 50 4.196 4.196 4.179 0.017 18755
1504 1 3 . 1 1 50 50 MET C C 50 178.300 178.300 177.399 0.901 18755
1505 1 3 . 1 1 50 50 MET CA C 50 57.557 57.557 59.398 -1.841 18755
1506 1 3 . 1 1 50 50 MET CB C 50 30.037 30.037 32.535 -2.498 18755
1507 1 3 . 1 1 50 50 MET H H 50 7.901 7.901 8.963 -1.062 18755
1508 1 3 . 1 1 51 51 LYS N N 51 115.600 115.600 119.179 -3.579 18755
1509 1 3 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.287 -0.002 18755
1510 1 3 . 1 1 51 51 LYS C C 51 179.100 179.100 178.476 0.624 18755
1511 1 3 . 1 1 51 51 LYS CA C 51 59.322 59.322 58.587 0.735 18755
1512 1 3 . 1 1 51 51 LYS CB C 51 32.140 32.140 32.106 0.034 18755
1513 1 3 . 1 1 51 51 LYS H H 51 8.413 8.413 7.553 0.860 18755
1514 1 3 . 1 1 52 52 GLU N N 52 120.906 120.906 120.819 0.087 18755
1515 1 3 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.820 0.583 18755
1516 1 3 . 1 1 52 52 GLU C C 52 178.200 178.200 178.195 0.005 18755
1517 1 3 . 1 1 52 52 GLU CA C 52 58.778 58.778 58.937 -0.159 18755
1518 1 3 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.433 2.357 18755
1519 1 3 . 1 1 52 52 GLU H H 52 7.646 7.646 7.914 -0.268 18755
1520 1 3 . 1 1 53 53 VAL N N 53 120.300 120.300 119.630 0.670 18755
1521 1 3 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.781 -0.600 18755
1522 1 3 . 1 1 53 53 VAL C C 53 177.500 177.500 177.941 -0.441 18755
1523 1 3 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.934 0.491 18755
1524 1 3 . 1 1 53 53 VAL CB C 53 30.360 30.360 31.054 -0.694 18755
1525 1 3 . 1 1 53 53 VAL H H 53 7.972 7.972 8.273 -0.301 18755
1526 1 3 . 1 1 54 54 LEU N N 54 120.594 120.594 117.959 2.635 18755
1527 1 3 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.051 -0.367 18755
1528 1 3 . 1 1 54 54 LEU C C 54 178.900 178.900 179.077 -0.177 18755
1529 1 3 . 1 1 54 54 LEU CA C 54 55.110 55.110 56.679 -1.569 18755
1530 1 3 . 1 1 54 54 LEU CB C 54 39.237 39.237 39.950 -0.713 18755
1531 1 3 . 1 1 54 54 LEU H H 54 8.063 8.063 7.795 0.268 18755
1532 1 3 . 1 1 55 55 PHE N N 55 120.300 120.300 119.857 0.443 18755
1533 1 3 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.065 -0.114 18755
1534 1 3 . 1 1 55 55 PHE C C 55 177.900 177.900 177.497 0.403 18755
1535 1 3 . 1 1 55 55 PHE CA C 55 61.017 61.017 62.203 -1.187 18755
1536 1 3 . 1 1 55 55 PHE CB C 55 38.083 38.083 39.001 -0.918 18755
1537 1 3 . 1 1 55 55 PHE H H 55 7.339 7.339 7.230 0.109 18755
1538 1 3 . 1 1 56 56 TYR N N 56 119.500 119.500 116.875 2.625 18755
1539 1 3 . 1 1 56 56 TYR HA H 56 3.740 3.740 3.954 -0.214 18755
1540 1 3 . 1 1 56 56 TYR C C 56 178.200 178.200 178.211 -0.011 18755
1541 1 3 . 1 1 56 56 TYR CA C 56 62.737 62.737 61.056 1.681 18755
1542 1 3 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.438 1.431 18755
1543 1 3 . 1 1 56 56 TYR H H 56 8.074 8.074 7.447 0.627 18755
1544 1 3 . 1 1 57 57 LEU N N 57 119.895 119.895 119.513 0.382 18755
1545 1 3 . 1 1 57 57 LEU HA H 57 3.858 3.858 4.202 -0.344 18755
1546 1 3 . 1 1 57 57 LEU C C 57 178.800 178.800 179.742 -0.942 18755
1547 1 3 . 1 1 57 57 LEU CA C 57 57.567 57.567 58.169 -0.602 18755
1548 1 3 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.358 0.800 18755
1549 1 3 . 1 1 57 57 LEU H H 57 8.628 8.628 8.362 0.266 18755
1550 1 3 . 1 1 58 58 GLY N N 58 107.015 107.015 106.424 0.591 18755
1551 1 3 . 1 1 58 58 GLY C C 58 175.028 175.028 176.070 -1.042 18755
1552 1 3 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.910 0.193 18755
1553 1 3 . 1 1 58 58 GLY H H 58 8.245 8.245 8.153 0.092 18755
1554 1 3 . 1 1 59 59 GLN N N 59 119.400 119.400 121.383 -1.983 18755
1555 1 3 . 1 1 59 59 GLN HA H 59 3.793 3.793 3.986 -0.193 18755
1556 1 3 . 1 1 59 59 GLN C C 59 178.900 178.900 176.991 1.909 18755
1557 1 3 . 1 1 59 59 GLN CA C 59 58.023 58.023 57.866 0.157 18755
1558 1 3 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.350 0.533 18755
1559 1 3 . 1 1 59 59 GLN H H 59 7.400 7.400 8.177 -0.777 18755
1560 1 3 . 1 1 60 60 TYR N N 60 123.589 123.589 122.385 1.204 18755
1561 1 3 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.120 -0.433 18755
1562 1 3 . 1 1 60 60 TYR C C 60 175.700 175.700 177.673 -1.973 18755
1563 1 3 . 1 1 60 60 TYR CA C 60 62.621 62.621 60.585 2.036 18755
1564 1 3 . 1 1 60 60 TYR CB C 60 38.069 38.069 37.959 0.111 18755
1565 1 3 . 1 1 60 60 TYR H H 60 8.521 8.521 8.146 0.375 18755
1566 1 3 . 1 1 61 61 ILE N N 61 118.996 118.996 118.428 0.568 18755
1567 1 3 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.277 -0.152 18755
1568 1 3 . 1 1 61 61 ILE C C 61 177.600 177.600 177.927 -0.327 18755
1569 1 3 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.581 0.327 18755
1570 1 3 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.458 0.635 18755
1571 1 3 . 1 1 61 61 ILE H H 61 8.240 8.240 7.458 0.782 18755
1572 1 3 . 1 1 62 62 MET N N 62 115.500 115.500 117.425 -1.925 18755
1573 1 3 . 1 1 62 62 MET HA H 62 4.333 4.333 3.832 0.501 18755
1574 1 3 . 1 1 62 62 MET C C 62 180.000 180.000 177.984 2.016 18755
1575 1 3 . 1 1 62 62 MET CA C 62 57.270 57.270 58.834 -1.564 18755
1576 1 3 . 1 1 62 62 MET CB C 62 30.961 30.961 32.360 -1.399 18755
1577 1 3 . 1 1 62 62 MET H H 62 7.750 7.750 7.252 0.498 18755
1578 1 3 . 1 1 63 63 THR N N 63 117.070 117.070 111.737 5.333 18755
1579 1 3 . 1 1 63 63 THR HA H 63 3.865 3.865 4.159 -0.294 18755
1580 1 3 . 1 1 63 63 THR C C 63 176.200 176.200 176.145 0.055 18755
1581 1 3 . 1 1 63 63 THR CA C 63 65.992 65.992 64.662 1.330 18755
1582 1 3 . 1 1 63 63 THR CB C 63 68.857 68.857 69.065 -0.208 18755
1583 1 3 . 1 1 63 63 THR H H 63 8.423 8.423 7.738 0.685 18755
1584 1 3 . 1 1 64 64 LYS N N 64 118.512 118.512 119.586 -1.074 18755
1585 1 3 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.411 -0.457 18755
1586 1 3 . 1 1 64 64 LYS C C 64 174.500 174.500 176.097 -1.597 18755
1587 1 3 . 1 1 64 64 LYS CA C 64 55.027 55.027 55.480 -0.453 18755
1588 1 3 . 1 1 64 64 LYS CB C 64 30.673 30.673 33.113 -2.440 18755
1589 1 3 . 1 1 64 64 LYS H H 64 7.678 7.678 7.761 -0.083 18755
1590 1 3 . 1 1 65 65 ARG N N 65 115.400 115.400 115.962 -0.562 18755
1591 1 3 . 1 1 65 65 ARG HA H 65 3.764 3.764 4.087 -0.323 18755
1592 1 3 . 1 1 65 65 ARG C C 65 175.900 175.900 176.604 -0.704 18755
1593 1 3 . 1 1 65 65 ARG CA C 65 56.475 56.475 56.656 -0.181 18755
1594 1 3 . 1 1 65 65 ARG CB C 65 25.911 25.911 26.950 -1.039 18755
1595 1 3 . 1 1 65 65 ARG H H 65 7.467 7.467 8.265 -0.798 18755
1596 1 3 . 1 1 66 66 LEU N N 66 115.591 115.591 116.690 -1.099 18755
1597 1 3 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.216 0.119 18755
1598 1 3 . 1 1 66 66 LEU C C 66 175.400 175.400 176.697 -1.297 18755
1599 1 3 . 1 1 66 66 LEU CA C 66 54.526 54.526 55.750 -1.224 18755
1600 1 3 . 1 1 66 66 LEU CB C 66 41.682 41.682 41.622 0.060 18755
1601 1 3 . 1 1 66 66 LEU H H 66 7.612 7.612 7.523 0.089 18755
1602 1 3 . 1 1 67 67 TYR N N 67 116.298 116.298 116.368 -0.070 18755
1603 1 3 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.052 0.699 18755
1604 1 3 . 1 1 67 67 TYR C C 67 173.576 173.576 174.740 -1.164 18755
1605 1 3 . 1 1 67 67 TYR CA C 67 55.334 55.334 54.347 0.987 18755
1606 1 3 . 1 1 67 67 TYR CB C 67 40.410 40.410 37.937 2.473 18755
1607 1 3 . 1 1 67 67 TYR H H 67 7.127 7.127 7.316 -0.189 18755
1608 1 3 . 1 1 68 68 ASP N N 68 124.792 124.792 123.617 1.175 18755
1609 1 3 . 1 1 68 68 ASP C C 68 175.741 175.741 175.006 0.735 18755
1610 1 3 . 1 1 68 68 ASP CA C 68 53.209 53.209 53.715 -0.506 18755
1611 1 3 . 1 1 68 68 ASP CB C 68 42.503 42.503 41.807 0.696 18755
1612 1 3 . 1 1 68 68 ASP H H 68 8.205 8.205 7.783 0.422 18755
1613 1 3 . 1 1 69 69 GLU N N 69 123.507 123.507 123.073 0.434 18755
1614 1 3 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.737 -0.940 18755
1615 1 3 . 1 1 69 69 GLU C C 69 176.859 176.859 176.429 0.430 18755
1616 1 3 . 1 1 69 69 GLU CA C 69 57.980 57.980 54.743 3.237 18755
1617 1 3 . 1 1 69 69 GLU CB C 69 29.260 29.260 29.709 -0.449 18755
1618 1 3 . 1 1 69 69 GLU H H 69 8.440 8.440 8.351 0.089 18755
1619 1 3 . 1 1 70 70 LYS N N 70 117.904 117.904 121.895 -3.991 18755
1620 1 3 . 1 1 70 70 LYS HA H 70 4.325 4.325 4.013 0.312 18755
1621 1 3 . 1 1 70 70 LYS C C 70 177.016 177.016 177.364 -0.348 18755
1622 1 3 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.501 -1.461 18755
1623 1 3 . 1 1 70 70 LYS CB C 70 32.090 32.090 32.015 0.075 18755
1624 1 3 . 1 1 70 70 LYS H H 70 8.208 8.208 8.632 -0.424 18755
1625 1 3 . 1 1 71 71 GLN N N 71 118.762 118.762 118.124 0.638 18755
1626 1 3 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.359 -0.034 18755
1627 1 3 . 1 1 71 71 GLN C C 71 175.300 175.300 176.086 -0.786 18755
1628 1 3 . 1 1 71 71 GLN CA C 71 54.920 54.920 56.638 -1.718 18755
1629 1 3 . 1 1 71 71 GLN CB C 71 28.850 28.850 30.072 -1.222 18755
1630 1 3 . 1 1 71 71 GLN H H 71 7.934 7.934 8.132 -0.198 18755
1631 1 3 . 1 1 72 72 GLN N N 72 118.200 118.200 117.517 0.683 18755
1632 1 3 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.112 -0.077 18755
1633 1 3 . 1 1 72 72 GLN C C 72 175.022 175.022 175.915 -0.893 18755
1634 1 3 . 1 1 72 72 GLN CA C 72 57.210 57.210 56.053 1.157 18755
1635 1 3 . 1 1 72 72 GLN CB C 72 27.880 27.880 29.604 -1.724 18755
1636 1 3 . 1 1 72 72 GLN H H 72 8.051 8.051 8.478 -0.427 18755
1637 1 3 . 1 1 74 74 ILE N N 74 120.607 120.607 120.162 0.445 18755
1638 1 3 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.871 0.442 18755
1639 1 3 . 1 1 74 74 ILE C C 74 174.400 174.400 175.096 -0.696 18755
1640 1 3 . 1 1 74 74 ILE CA C 74 58.521 58.521 62.155 -3.634 18755
1641 1 3 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.197 -0.955 18755
1642 1 3 . 1 1 75 75 VAL N N 75 126.197 126.197 121.886 4.311 18755
1643 1 3 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.252 -0.491 18755
1644 1 3 . 1 1 75 75 VAL C C 75 174.100 174.100 173.616 0.484 18755
1645 1 3 . 1 1 75 75 VAL CA C 75 60.538 60.538 58.740 1.798 18755
1646 1 3 . 1 1 75 75 VAL CB C 75 31.759 31.759 34.843 -3.084 18755
1647 1 3 . 1 1 75 75 VAL H H 75 8.274 8.274 7.665 0.609 18755
1648 1 3 . 1 1 76 76 TYR N N 76 126.301 126.301 123.164 3.137 18755
1649 1 3 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.535 -0.966 18755
1650 1 3 . 1 1 76 76 TYR C C 76 175.000 175.000 175.944 -0.944 18755
1651 1 3 . 1 1 76 76 TYR CA C 76 57.648 57.648 54.992 2.656 18755
1652 1 3 . 1 1 76 76 TYR CB C 76 38.188 38.188 40.899 -2.711 18755
1653 1 3 . 1 1 76 76 TYR H H 76 8.110 8.110 7.461 0.649 18755
1654 1 3 . 1 1 77 77 CYS N N 77 117.781 117.781 117.222 0.559 18755
1655 1 3 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.717 0.065 18755
1656 1 3 . 1 1 77 77 CYS C C 77 173.429 173.429 173.844 -0.415 18755
1657 1 3 . 1 1 77 77 CYS CA C 77 55.361 55.361 56.736 -1.375 18755
1658 1 3 . 1 1 77 77 CYS CB C 77 29.255 29.255 30.810 -1.555 18755
1659 1 3 . 1 1 77 77 CYS H H 77 8.295 8.295 8.657 -0.362 18755
1660 1 3 . 1 1 78 78 SER N N 78 116.896 116.896 115.992 0.904 18755
1661 1 3 . 1 1 78 78 SER HA H 78 4.182 4.182 4.704 -0.522 18755
1662 1 3 . 1 1 78 78 SER CA C 78 60.064 60.064 56.949 3.115 18755
1663 1 3 . 1 1 78 78 SER CB C 78 63.122 63.122 64.505 -1.383 18755
1664 1 3 . 1 1 78 78 SER H H 78 7.585 7.585 8.331 -0.746 18755
1665 1 3 . 1 1 79 79 ASN N N 79 118.100 118.100 117.868 0.232 18755
1666 1 3 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.613 0.018 18755
1667 1 3 . 1 1 79 79 ASN C C 79 172.700 172.700 174.777 -2.077 18755
1668 1 3 . 1 1 79 79 ASN CA C 79 52.850 52.850 54.200 -1.349 18755
1669 1 3 . 1 1 79 79 ASN CB C 79 37.796 37.796 38.285 -0.489 18755
1670 1 3 . 1 1 79 79 ASN H H 79 8.609 8.609 8.597 0.012 18755
1671 1 3 . 1 1 80 80 ASP N N 80 118.603 118.603 118.247 0.356 18755
1672 1 3 . 1 1 80 80 ASP HA H 80 4.774 4.774 4.540 0.234 18755
1673 1 3 . 1 1 80 80 ASP C C 80 174.900 174.900 178.116 -3.216 18755
1674 1 3 . 1 1 80 80 ASP CA C 80 52.802 52.802 54.912 -2.110 18755
1675 1 3 . 1 1 80 80 ASP CB C 80 47.221 47.221 41.187 6.034 18755
1676 1 3 . 1 1 80 80 ASP H H 80 7.549 7.549 7.848 -0.299 18755
1677 1 3 . 1 1 81 81 LEU N N 81 129.094 129.094 119.151 9.943 18755
1678 1 3 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.362 -0.253 18755
1679 1 3 . 1 1 81 81 LEU C C 81 177.800 177.800 178.106 -0.306 18755
1680 1 3 . 1 1 81 81 LEU CA C 81 57.666 57.666 56.828 0.838 18755
1681 1 3 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.368 0.658 18755
1682 1 3 . 1 1 81 81 LEU H H 81 8.411 8.411 8.960 -0.549 18755
1683 1 3 . 1 1 82 82 LEU N N 82 118.601 118.601 121.846 -3.245 18755
1684 1 3 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.162 -0.698 18755
1685 1 3 . 1 1 82 82 LEU C C 82 178.100 178.100 178.554 -0.454 18755
1686 1 3 . 1 1 82 82 LEU CA C 82 57.811 57.811 56.445 1.366 18755
1687 1 3 . 1 1 82 82 LEU CB C 82 42.416 42.416 40.581 1.835 18755
1688 1 3 . 1 1 82 82 LEU H H 82 9.777 9.777 8.175 1.602 18755
1689 1 3 . 1 1 83 83 GLY N N 83 105.800 105.800 105.938 -0.138 18755
1690 1 3 . 1 1 83 83 GLY C C 83 176.900 176.900 175.646 1.254 18755
1691 1 3 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.530 1.024 18755
1692 1 3 . 1 1 83 83 GLY H H 83 7.592 7.592 7.863 -0.271 18755
1693 1 3 . 1 1 84 84 ASP N N 84 123.089 123.089 121.951 1.138 18755
1694 1 3 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.468 -0.186 18755
1695 1 3 . 1 1 84 84 ASP C C 84 178.600 178.600 177.283 1.317 18755
1696 1 3 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.851 -0.271 18755
1697 1 3 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.674 -0.779 18755
1698 1 3 . 1 1 84 84 ASP H H 84 7.366 7.366 8.303 -0.937 18755
1699 1 3 . 1 1 85 85 LEU N N 85 118.800 118.800 118.526 0.274 18755
1700 1 3 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.944 0.043 18755
1701 1 3 . 1 1 85 85 LEU C C 85 178.900 178.900 178.107 0.793 18755
1702 1 3 . 1 1 85 85 LEU CA C 85 56.984 56.984 57.127 -0.143 18755
1703 1 3 . 1 1 85 85 LEU CB C 85 41.221 41.221 41.884 -0.663 18755
1704 1 3 . 1 1 85 85 LEU H H 85 7.981 7.981 7.414 0.567 18755
1705 1 3 . 1 1 86 86 PHE N N 86 117.812 117.812 114.397 3.415 18755
1706 1 3 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.367 0.035 18755
1707 1 3 . 1 1 86 86 PHE C C 86 176.400 176.400 177.589 -1.189 18755
1708 1 3 . 1 1 86 86 PHE CA C 86 55.833 55.833 58.590 -2.757 18755
1709 1 3 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.406 -2.078 18755
1710 1 3 . 1 1 86 86 PHE H H 86 8.531 8.531 7.298 1.233 18755
1711 1 3 . 1 1 87 87 GLY N N 87 107.899 107.899 107.823 0.076 18755
1712 1 3 . 1 1 87 87 GLY C C 87 173.800 173.800 173.942 -0.142 18755
1713 1 3 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.752 0.135 18755
1714 1 3 . 1 1 87 87 GLY H H 87 8.150 8.150 8.144 0.006 18755
1715 1 3 . 1 1 88 88 VAL N N 88 108.596 108.596 112.793 -4.197 18755
1716 1 3 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.792 0.105 18755
1717 1 3 . 1 1 88 88 VAL C C 88 174.100 174.100 174.188 -0.088 18755
1718 1 3 . 1 1 88 88 VAL CA C 88 56.703 56.703 58.259 -1.556 18755
1719 1 3 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.599 1.200 18755
1720 1 3 . 1 1 88 88 VAL H H 88 7.073 7.073 7.513 -0.440 18755
1721 1 3 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.626 -0.284 18755
1722 1 3 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.468 -1.588 18755
1723 1 3 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.091 -0.471 18755
1724 1 3 . 1 1 90 90 SER N N 90 110.799 110.799 114.719 -3.920 18755
1725 1 3 . 1 1 90 90 SER HA H 90 5.362 5.362 5.014 0.348 18755
1726 1 3 . 1 1 90 90 SER C C 90 172.300 172.300 173.397 -1.097 18755
1727 1 3 . 1 1 90 90 SER CA C 90 56.470 56.470 57.105 -0.635 18755
1728 1 3 . 1 1 90 90 SER CB C 90 64.481 64.481 65.514 -1.033 18755
1729 1 3 . 1 1 90 90 SER H H 90 7.115 7.115 7.733 -0.618 18755
1730 1 3 . 1 1 91 91 PHE N N 91 112.909 112.909 121.641 -8.732 18755
1731 1 3 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.937 -0.176 18755
1732 1 3 . 1 1 91 91 PHE C C 91 171.600 171.600 175.059 -3.459 18755
1733 1 3 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.724 0.825 18755
1734 1 3 . 1 1 91 91 PHE CB C 91 39.765 39.765 40.673 -0.909 18755
1735 1 3 . 1 1 91 91 PHE H H 91 8.008 8.008 8.143 -0.135 18755
1736 1 3 . 1 1 92 92 SER N N 92 113.293 113.293 120.317 -7.024 18755
1737 1 3 . 1 1 92 92 SER HA H 92 5.184 5.184 4.485 0.699 18755
1738 1 3 . 1 1 92 92 SER C C 92 177.900 177.900 175.527 2.373 18755
1739 1 3 . 1 1 92 92 SER CA C 92 55.256 55.256 58.153 -2.897 18755
1740 1 3 . 1 1 92 92 SER CB C 92 63.592 63.592 62.640 0.952 18755
1741 1 3 . 1 1 92 92 SER H H 92 8.708 8.708 8.959 -0.251 18755
1742 1 3 . 1 1 93 93 VAL N N 93 121.309 121.309 125.999 -4.690 18755
1743 1 3 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.757 0.548 18755
1744 1 3 . 1 1 93 93 VAL C C 93 173.760 173.760 175.767 -2.007 18755
1745 1 3 . 1 1 93 93 VAL CA C 93 63.973 63.973 66.159 -2.186 18755
1746 1 3 . 1 1 93 93 VAL CB C 93 31.402 31.402 32.040 -0.638 18755
1747 1 3 . 1 1 93 93 VAL H H 93 8.879 8.879 7.962 0.917 18755
1748 1 3 . 1 1 94 94 LYS N N 94 113.118 113.118 113.718 -0.600 18755
1749 1 3 . 1 1 94 94 LYS HA H 94 4.380 4.380 3.880 0.500 18755
1750 1 3 . 1 1 94 94 LYS C C 94 177.300 177.300 176.332 0.968 18755
1751 1 3 . 1 1 94 94 LYS CA C 94 55.036 55.036 57.488 -2.452 18755
1752 1 3 . 1 1 94 94 LYS CB C 94 32.231 32.231 31.753 0.478 18755
1753 1 3 . 1 1 94 94 LYS H H 94 7.836 7.836 8.117 -0.281 18755
1754 1 3 . 1 1 95 95 GLU N N 95 119.700 119.700 119.847 -0.147 18755
1755 1 3 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.472 0.013 18755
1756 1 3 . 1 1 95 95 GLU C C 95 176.100 176.100 176.675 -0.575 18755
1757 1 3 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.663 -0.077 18755
1758 1 3 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.919 0.023 18755
1759 1 3 . 1 1 95 95 GLU H H 95 6.901 6.901 7.862 -0.961 18755
1760 1 3 . 1 1 96 96 HIS N N 96 121.512 121.512 120.204 1.308 18755
1761 1 3 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.231 0.126 18755
1762 1 3 . 1 1 96 96 HIS C C 96 177.300 177.300 177.248 0.052 18755
1763 1 3 . 1 1 96 96 HIS CA C 96 58.495 58.495 61.038 -2.543 18755
1764 1 3 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.775 1.190 18755
1765 1 3 . 1 1 96 96 HIS H H 96 7.568 7.568 7.022 0.546 18755
1766 1 3 . 1 1 97 97 ARG N N 97 120.300 120.300 119.197 1.103 18755
1767 1 3 . 1 1 97 97 ARG HA H 97 3.888 3.888 3.957 -0.069 18755
1768 1 3 . 1 1 97 97 ARG C C 97 177.800 177.800 177.657 0.143 18755
1769 1 3 . 1 1 97 97 ARG CA C 97 57.432 57.432 59.659 -2.227 18755
1770 1 3 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.887 -4.037 18755
1771 1 3 . 1 1 98 98 LYS N N 98 120.600 120.600 119.472 1.128 18755
1772 1 3 . 1 1 98 98 LYS C C 98 178.500 178.500 179.079 -0.579 18755
1773 1 3 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.701 0.369 18755
1774 1 3 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.650 -0.830 18755
1775 1 3 . 1 1 98 98 LYS H H 98 7.741 7.741 8.051 -0.310 18755
1776 1 3 . 1 1 99 99 ILE N N 99 119.394 119.394 117.740 1.654 18755
1777 1 3 . 1 1 99 99 ILE HA H 99 3.017 3.017 3.867 -0.850 18755
1778 1 3 . 1 1 99 99 ILE C C 99 177.000 177.000 178.385 -1.385 18755
1779 1 3 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.009 0.855 18755
1780 1 3 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.528 0.156 18755
1781 1 3 . 1 1 99 99 ILE H H 99 7.585 7.585 8.002 -0.417 18755
1782 1 3 . 1 1 100 100 TYR N N 100 121.894 121.894 119.167 2.727 18755
1783 1 3 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.220 -1.027 18755
1784 1 3 . 1 1 100 100 TYR C C 100 176.500 176.500 178.476 -1.976 18755
1785 1 3 . 1 1 100 100 TYR CA C 100 63.706 63.706 62.729 0.977 18755
1786 1 3 . 1 1 100 100 TYR CB C 100 37.142 37.142 38.062 -0.920 18755
1787 1 3 . 1 1 100 100 TYR H H 100 8.430 8.430 9.141 -0.711 18755
1788 1 3 . 1 1 101 101 THR N N 101 113.693 113.693 115.568 -1.875 18755
1789 1 3 . 1 1 101 101 THR HA H 101 3.805 3.805 4.170 -0.365 18755
1790 1 3 . 1 1 101 101 THR C C 101 176.100 176.100 176.010 0.090 18755
1791 1 3 . 1 1 101 101 THR CA C 101 67.003 67.003 66.677 0.326 18755
1792 1 3 . 1 1 101 101 THR CB C 101 68.496 68.496 68.771 -0.275 18755
1793 1 3 . 1 1 101 101 THR H H 101 8.232 8.232 7.649 0.583 18755
1794 1 3 . 1 1 102 102 MET N N 102 119.500 119.500 116.458 3.042 18755
1795 1 3 . 1 1 102 102 MET C C 102 178.000 178.000 178.996 -0.996 18755
1796 1 3 . 1 1 102 102 MET CA C 102 59.360 59.360 58.392 0.968 18755
1797 1 3 . 1 1 102 102 MET CB C 102 31.110 31.110 32.413 -1.302 18755
1798 1 3 . 1 1 102 102 MET H H 102 7.461 7.461 7.496 -0.035 18755
1799 1 3 . 1 1 103 103 ILE N N 103 120.103 120.103 121.408 -1.305 18755
1800 1 3 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.554 -0.391 18755
1801 1 3 . 1 1 103 103 ILE C C 103 178.700 178.700 178.635 0.065 18755
1802 1 3 . 1 1 103 103 ILE CA C 103 66.114 66.114 65.025 1.089 18755
1803 1 3 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.531 -0.147 18755
1804 1 3 . 1 1 103 103 ILE H H 103 7.824 7.824 8.044 -0.220 18755
1805 1 3 . 1 1 104 104 TYR N N 104 119.500 119.500 119.553 -0.053 18755
1806 1 3 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.295 -0.230 18755
1807 1 3 . 1 1 104 104 TYR C C 104 177.300 177.300 175.638 1.662 18755
1808 1 3 . 1 1 104 104 TYR CA C 104 60.505 60.505 59.763 0.742 18755
1809 1 3 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.344 -0.701 18755
1810 1 3 . 1 1 104 104 TYR H H 104 8.694 8.694 8.678 0.016 18755
1811 1 3 . 1 1 105 105 ARG N N 105 114.400 114.400 117.197 -2.797 18755
1812 1 3 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.385 -0.148 18755
1813 1 3 . 1 1 105 105 ARG C C 105 176.500 176.500 175.635 0.865 18755
1814 1 3 . 1 1 105 105 ARG CA C 105 58.128 58.128 54.997 3.131 18755
1815 1 3 . 1 1 105 105 ARG CB C 105 30.266 30.266 30.472 -0.206 18755
1816 1 3 . 1 1 105 105 ARG H H 105 6.713 6.713 7.705 -0.992 18755
1817 1 3 . 1 1 106 106 ASN N N 106 116.011 116.011 118.238 -2.227 18755
1818 1 3 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.859 -0.025 18755
1819 1 3 . 1 1 106 106 ASN C C 106 171.800 171.800 173.351 -1.551 18755
1820 1 3 . 1 1 106 106 ASN CA C 106 53.484 53.484 53.204 0.280 18755
1821 1 3 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.648 1.298 18755
1822 1 3 . 1 1 106 106 ASN H H 106 8.396 8.396 8.099 0.297 18755
1823 1 3 . 1 1 107 107 LEU N N 107 115.594 115.594 116.805 -1.211 18755
1824 1 3 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.891 -0.112 18755
1825 1 3 . 1 1 107 107 LEU C C 107 173.500 173.500 174.789 -1.289 18755
1826 1 3 . 1 1 107 107 LEU CA C 107 54.230 54.230 52.867 1.363 18755
1827 1 3 . 1 1 107 107 LEU CB C 107 45.490 45.490 44.403 1.087 18755
1828 1 3 . 1 1 107 107 LEU H H 107 7.551 7.551 7.404 0.147 18755
1829 1 3 . 1 1 108 108 VAL N N 108 117.493 117.493 119.601 -2.108 18755
1830 1 3 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.478 -0.164 18755
1831 1 3 . 1 1 108 108 VAL C C 108 175.100 175.100 175.404 -0.304 18755
1832 1 3 . 1 1 108 108 VAL CA C 108 60.620 60.620 60.494 0.126 18755
1833 1 3 . 1 1 108 108 VAL CB C 108 34.322 34.322 31.247 3.075 18755
1834 1 3 . 1 1 108 108 VAL H H 108 7.906 7.906 8.595 -0.689 18755
1835 1 3 . 1 1 109 109 VAL N N 109 128.100 128.100 123.268 4.832 18755
1836 1 3 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.208 -0.229 18755
1837 1 3 . 1 1 109 109 VAL C C 109 176.000 176.000 175.527 0.473 18755
1838 1 3 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.296 1.023 18755
1839 1 3 . 1 1 109 109 VAL CB C 109 31.909 31.909 32.333 -0.424 18755
1840 1 3 . 1 1 109 109 VAL H H 109 8.740 8.740 8.436 0.304 18755
1841 1 3 . 1 1 110 110 VAL N N 110 127.704 127.704 123.412 4.292 18755
1842 1 3 . 1 1 110 110 VAL HA H 110 3.785 3.785 4.222 -0.437 18755
1843 1 3 . 1 1 110 110 VAL C C 110 175.300 175.300 176.176 -0.876 18755
1844 1 3 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.731 -0.841 18755
1845 1 3 . 1 1 110 110 VAL H H 110 8.283 8.283 8.784 -0.501 18755
1846 1 3 . 1 1 111 111 ASN N N 111 122.500 122.500 118.286 4.214 18755
1847 1 3 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.944 -0.318 18755
1848 1 3 . 1 1 111 111 ASN C C 111 174.728 174.728 173.525 1.203 18755
1849 1 3 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.845 -0.027 18755
1850 1 3 . 1 1 111 111 ASN CB C 111 38.664 38.664 40.728 -2.064 18755
1851 1 3 . 1 1 111 111 ASN H H 111 8.488 8.488 8.174 0.314 18755
1852 1 3 . 1 1 112 112 GLN N N 112 121.700 121.700 120.132 1.568 18755
1853 1 3 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.641 -0.447 18755
1854 1 3 . 1 1 112 112 GLN C C 112 175.600 175.600 175.129 0.471 18755
1855 1 3 . 1 1 112 112 GLN CA C 112 55.958 55.958 54.775 1.183 18755
1856 1 3 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.225 -1.250 18755
1857 1 3 . 1 1 112 112 GLN H H 112 8.366 8.366 8.499 -0.133 18755
1858 1 3 . 1 1 113 113 GLN N N 113 122.200 122.200 119.411 2.789 18755
1859 1 3 . 1 1 113 113 GLN C C 113 176.200 176.200 175.125 1.075 18755
1860 1 3 . 1 1 113 113 GLN CA C 113 56.500 56.500 56.487 0.013 18755
1861 1 3 . 1 1 113 113 GLN CB C 113 30.030 30.030 30.216 -0.186 18755
1862 1 3 . 1 1 113 113 GLN H H 113 8.331 8.331 8.605 -0.274 18755
1863 1 3 . 1 1 115 115 SER N N 115 116.889 116.889 115.264 1.625 18755
1864 1 3 . 1 1 115 115 SER HA H 115 4.392 4.392 4.233 0.159 18755
1865 1 3 . 1 1 115 115 SER C C 115 174.412 174.412 174.441 -0.029 18755
1866 1 3 . 1 1 115 115 SER CA C 115 57.837 57.837 59.998 -2.161 18755
1867 1 3 . 1 1 115 115 SER CB C 115 63.574 63.574 63.280 0.294 18755
1868 1 3 . 1 1 115 115 SER H H 115 8.302 8.302 8.462 -0.160 18755
1869 1 3 . 1 1 116 116 SER N N 116 118.000 118.000 116.204 1.796 18755
1870 1 3 . 1 1 116 116 SER HA H 116 4.381 4.381 4.549 -0.168 18755
1871 1 3 . 1 1 116 116 SER C C 116 174.100 174.100 172.927 1.173 18755
1872 1 3 . 1 1 116 116 SER CA C 116 58.062 58.062 56.844 1.218 18755
1873 1 3 . 1 1 116 116 SER CB C 116 63.460 63.460 64.985 -1.525 18755
1874 1 3 . 1 1 116 116 SER H H 116 8.350 8.350 7.576 0.774 18755
1875 1 3 . 1 1 117 117 ASP N N 117 122.400 122.400 125.206 -2.806 18755
1876 1 3 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.387 0.164 18755
1877 1 3 . 1 1 117 117 ASP C C 117 176.200 176.200 176.294 -0.094 18755
1878 1 3 . 1 1 117 117 ASP CA C 117 54.140 54.140 56.465 -2.325 18755
1879 1 3 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.460 -0.480 18755
1880 1 3 . 1 1 117 117 ASP H H 117 8.274 8.274 8.570 -0.296 18755
1881 1 3 . 1 1 118 118 SER N N 118 116.593 116.593 119.796 -3.203 18755
1882 1 3 . 1 1 118 118 SER HA H 118 4.296 4.296 4.745 -0.449 18755
1883 1 3 . 1 1 118 118 SER C C 118 175.000 175.000 174.502 0.498 18755
1884 1 3 . 1 1 118 118 SER CA C 118 58.660 58.660 58.063 0.597 18755
1885 1 3 . 1 1 118 118 SER CB C 118 63.550 63.550 65.437 -1.887 18755
1886 1 3 . 1 1 118 118 SER H H 118 8.210 8.210 8.115 0.095 18755
1887 1 3 . 1 1 119 119 GLY N N 119 110.896 110.896 112.007 -1.111 18755
1888 1 3 . 1 1 119 119 GLY C C 119 174.100 174.100 175.060 -0.960 18755
1889 1 3 . 1 1 119 119 GLY CA C 119 45.180 45.180 46.238 -1.058 18755
1890 1 3 . 1 1 119 119 GLY H H 119 8.376 8.376 8.573 -0.197 18755
1891 1 3 . 1 1 120 120 THR N N 120 113.503 113.503 111.966 1.537 18755
1892 1 3 . 1 1 120 120 THR HA H 120 4.255 4.255 4.350 -0.095 18755
1893 1 3 . 1 1 120 120 THR C C 120 174.385 174.385 174.008 0.377 18755
1894 1 3 . 1 1 120 120 THR CA C 120 61.490 61.490 61.611 -0.121 18755
1895 1 3 . 1 1 120 120 THR CB C 120 69.690 69.690 69.599 0.091 18755
1896 1 3 . 1 1 120 120 THR H H 120 7.932 7.932 8.168 -0.236 18755
1897 1 3 . 1 1 121 121 SER N N 121 118.800 118.800 118.567 0.233 18755
1898 1 3 . 1 1 121 121 SER HA H 121 4.354 4.354 4.644 -0.290 18755
1899 1 3 . 1 1 121 121 SER C C 121 174.120 174.120 173.371 0.749 18755
1900 1 3 . 1 1 121 121 SER CA C 121 57.876 57.876 58.109 -0.233 18755
1901 1 3 . 1 1 121 121 SER CB C 121 63.650 63.650 64.191 -0.541 18755
1902 1 3 . 1 1 121 121 SER H H 121 8.284 8.284 7.950 0.334 18755
1903 1 3 . 1 1 122 122 VAL N N 122 121.801 121.801 124.207 -2.406 18755
1904 1 3 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.391 -0.321 18755
1905 1 3 . 1 1 122 122 VAL C C 122 175.900 175.900 174.508 1.392 18755
1906 1 3 . 1 1 122 122 VAL CA C 122 61.859 61.859 62.222 -0.363 18755
1907 1 3 . 1 1 122 122 VAL CB C 122 32.315 32.315 32.791 -0.476 18755
1908 1 3 . 1 1 122 122 VAL H H 122 8.131 8.131 8.463 -0.332 18755
1909 1 3 . 1 1 123 123 SER N N 123 119.593 119.593 122.381 -2.788 18755
1910 1 3 . 1 1 123 123 SER HA H 123 4.331 4.331 4.866 -0.535 18755
1911 1 3 . 1 1 123 123 SER C C 123 174.000 174.000 173.758 0.242 18755
1912 1 3 . 1 1 123 123 SER CA C 123 57.780 57.780 57.425 0.355 18755
1913 1 3 . 1 1 123 123 SER CB C 123 63.720 63.720 65.905 -2.185 18755
1914 1 3 . 1 1 123 123 SER H H 123 8.277 8.277 8.291 -0.014 18755
1915 1 3 . 1 1 124 124 GLU N N 124 123.501 123.501 120.905 2.596 18755
1916 1 3 . 1 1 124 124 GLU HA H 124 4.186 4.186 4.547 -0.361 18755
1917 1 3 . 1 1 124 124 GLU C C 124 175.060 175.060 176.036 -0.976 18755
1918 1 3 . 1 1 124 124 GLU CA C 124 56.200 56.200 56.692 -0.492 18755
1919 1 3 . 1 1 124 124 GLU CB C 124 30.270 30.270 29.659 0.611 18755
1920 1 3 . 1 1 124 124 GLU H H 124 8.378 8.378 8.744 -0.366 18755
1921 1 4 . 1 1 2 2 CYS N N 2 123.192 123.192 121.187 2.005 18755
1922 1 4 . 1 1 2 2 CYS H H 2 8.252 8.252 8.695 -0.443 18755
1923 1 4 . 1 1 3 3 ASN N N 3 123.749 123.749 121.401 2.348 18755
1924 1 4 . 1 1 3 3 ASN H H 3 8.128 8.128 8.364 -0.236 18755
1925 1 4 . 1 1 6 6 MET N N 6 119.009 119.009 120.806 -1.797 18755
1926 1 4 . 1 1 6 6 MET CA C 6 43.265 43.265 54.986 -11.721 18755
1927 1 4 . 1 1 6 6 MET CB C 6 27.431 27.431 34.501 -7.070 18755
1928 1 4 . 1 1 6 6 MET H H 6 7.099 7.099 8.134 -1.035 18755
1929 1 4 . 1 1 7 7 SER N N 7 119.000 119.000 117.845 1.155 18755
1930 1 4 . 1 1 7 7 SER HA H 7 4.337 4.337 4.343 -0.006 18755
1931 1 4 . 1 1 7 7 SER C C 7 177.600 177.600 174.140 3.460 18755
1932 1 4 . 1 1 7 7 SER CA C 7 57.850 57.850 59.838 -1.988 18755
1933 1 4 . 1 1 7 7 SER CB C 7 63.720 63.720 63.313 0.407 18755
1934 1 4 . 1 1 7 7 SER H H 7 8.246 8.246 8.606 -0.360 18755
1935 1 4 . 1 1 8 8 VAL N N 8 126.800 126.800 120.882 5.918 18755
1936 1 4 . 1 1 8 8 VAL HA H 8 4.290 4.290 4.356 -0.066 18755
1937 1 4 . 1 1 8 8 VAL C C 8 180.600 180.600 173.208 7.392 18755
1938 1 4 . 1 1 8 8 VAL CA C 8 55.790 55.790 60.790 -5.000 18755
1939 1 4 . 1 1 8 8 VAL CB C 8 41.860 41.860 32.325 9.535 18755
1940 1 4 . 1 1 8 8 VAL H H 8 7.988 7.988 7.864 0.124 18755
1941 1 4 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.803 -0.452 18755
1942 1 4 . 1 1 9 9 PRO C C 9 176.757 176.757 176.891 -0.134 18755
1943 1 4 . 1 1 10 10 THR N N 10 113.463 113.463 113.305 0.158 18755
1944 1 4 . 1 1 10 10 THR HA H 10 4.235 4.235 4.465 -0.231 18755
1945 1 4 . 1 1 10 10 THR C C 10 174.000 174.000 174.769 -0.769 18755
1946 1 4 . 1 1 10 10 THR CA C 10 61.265 61.265 64.171 -2.906 18755
1947 1 4 . 1 1 10 10 THR CB C 10 69.466 69.466 69.295 0.171 18755
1948 1 4 . 1 1 10 10 THR H H 10 8.109 8.109 8.681 -0.572 18755
1949 1 4 . 1 1 11 11 ASP N N 11 122.009 122.009 119.045 2.964 18755
1950 1 4 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.804 -0.381 18755
1951 1 4 . 1 1 11 11 ASP C C 11 175.900 175.900 176.747 -0.847 18755
1952 1 4 . 1 1 11 11 ASP CA C 11 54.245 54.245 53.822 0.423 18755
1953 1 4 . 1 1 11 11 ASP CB C 11 40.957 40.957 42.165 -1.208 18755
1954 1 4 . 1 1 11 11 ASP H H 11 8.180 8.180 8.612 -0.432 18755
1955 1 4 . 1 1 12 12 GLY N N 12 108.549 108.549 108.708 -0.159 18755
1956 1 4 . 1 1 12 12 GLY C C 12 171.700 171.700 172.193 -0.493 18755
1957 1 4 . 1 1 12 12 GLY CA C 12 44.481 44.481 44.905 -0.424 18755
1958 1 4 . 1 1 12 12 GLY H H 12 7.409 7.409 8.182 -0.773 18755
1959 1 4 . 1 1 13 13 ALA N N 13 119.600 119.600 119.622 -0.022 18755
1960 1 4 . 1 1 13 13 ALA HA H 13 4.302 4.302 3.393 0.909 18755
1961 1 4 . 1 1 13 13 ALA C C 13 176.400 176.400 174.225 2.175 18755
1962 1 4 . 1 1 13 13 ALA CA C 13 51.676 51.676 50.809 0.867 18755
1963 1 4 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.068 0.578 18755
1964 1 4 . 1 1 13 13 ALA H H 13 7.288 7.288 6.928 0.360 18755
1965 1 4 . 1 1 14 14 VAL N N 14 118.098 118.098 118.229 -0.131 18755
1966 1 4 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.363 0.185 18755
1967 1 4 . 1 1 14 14 VAL C C 14 174.300 174.300 175.525 -1.225 18755
1968 1 4 . 1 1 14 14 VAL CA C 14 60.637 60.637 60.835 -0.198 18755
1969 1 4 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.230 0.943 18755
1970 1 4 . 1 1 14 14 VAL H H 14 8.091 8.091 8.427 -0.336 18755
1971 1 4 . 1 1 15 15 THR N N 15 116.900 116.900 116.508 0.392 18755
1972 1 4 . 1 1 15 15 THR HA H 15 4.750 4.750 4.594 0.156 18755
1973 1 4 . 1 1 15 15 THR C C 15 173.364 173.364 173.182 0.182 18755
1974 1 4 . 1 1 15 15 THR CA C 15 60.011 60.011 61.654 -1.643 18755
1975 1 4 . 1 1 15 15 THR CB C 15 71.125 71.125 71.380 -0.256 18755
1976 1 4 . 1 1 15 15 THR H H 15 8.303 8.303 8.328 -0.025 18755
1977 1 4 . 1 1 16 16 THR N N 16 116.004 116.004 116.352 -0.348 18755
1978 1 4 . 1 1 16 16 THR HA H 16 4.678 4.678 4.204 0.474 18755
1979 1 4 . 1 1 16 16 THR C C 16 173.665 173.665 173.301 0.364 18755
1980 1 4 . 1 1 16 16 THR CA C 16 57.028 57.028 60.838 -3.810 18755
1981 1 4 . 1 1 16 16 THR CB C 16 67.263 67.263 71.062 -3.799 18755
1982 1 4 . 1 1 16 16 THR H H 16 8.352 8.352 8.140 0.212 18755
1983 1 4 . 1 1 17 17 SER N N 17 121.926 121.926 115.947 5.979 18755
1984 1 4 . 1 1 17 17 SER HA H 17 4.440 4.440 4.649 -0.209 18755
1985 1 4 . 1 1 17 17 SER CA C 17 58.639 58.639 59.513 -0.874 18755
1986 1 4 . 1 1 17 17 SER CB C 17 63.087 63.087 64.197 -1.110 18755
1987 1 4 . 1 1 17 17 SER H H 17 8.566 8.566 8.957 -0.391 18755
1988 1 4 . 1 1 18 18 GLN N N 18 121.238 121.238 120.133 1.105 18755
1989 1 4 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.368 -0.420 18755
1990 1 4 . 1 1 18 18 GLN C C 18 174.237 174.237 175.436 -1.199 18755
1991 1 4 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.497 -0.012 18755
1992 1 4 . 1 1 18 18 GLN CB C 18 29.687 29.687 29.947 -0.260 18755
1993 1 4 . 1 1 18 18 GLN H H 18 9.115 9.115 8.666 0.449 18755
1994 1 4 . 1 1 19 19 ILE N N 19 117.894 117.894 116.053 1.841 18755
1995 1 4 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.127 0.203 18755
1996 1 4 . 1 1 19 19 ILE C C 19 173.200 173.200 173.265 -0.065 18755
1997 1 4 . 1 1 19 19 ILE CA C 19 54.716 54.716 59.023 -4.306 18755
1998 1 4 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.305 1.753 18755
1999 1 4 . 1 1 19 19 ILE H H 19 6.487 6.487 7.927 -1.440 18755
2000 1 4 . 1 1 21 21 ALA N N 21 128.900 128.900 122.007 6.893 18755
2001 1 4 . 1 1 21 21 ALA HA H 21 3.890 3.890 3.959 -0.069 18755
2002 1 4 . 1 1 21 21 ALA C C 21 180.600 180.600 179.600 1.000 18755
2003 1 4 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.307 0.601 18755
2004 1 4 . 1 1 21 21 ALA CB C 21 17.767 17.767 18.352 -0.585 18755
2005 1 4 . 1 1 21 21 ALA H H 21 8.867 8.867 8.764 0.103 18755
2006 1 4 . 1 1 22 22 SER N N 22 111.315 111.315 112.829 -1.514 18755
2007 1 4 . 1 1 22 22 SER HA H 22 3.787 3.787 4.094 -0.307 18755
2008 1 4 . 1 1 22 22 SER C C 22 178.400 178.400 175.485 2.915 18755
2009 1 4 . 1 1 22 22 SER CA C 22 61.138 61.138 60.775 0.363 18755
2010 1 4 . 1 1 22 22 SER CB C 22 60.854 60.854 62.596 -1.742 18755
2011 1 4 . 1 1 22 22 SER H H 22 8.752 8.752 8.306 0.446 18755
2012 1 4 . 1 1 23 23 GLU N N 23 122.700 122.700 118.841 3.859 18755
2013 1 4 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.413 -0.405 18755
2014 1 4 . 1 1 23 23 GLU C C 23 179.100 179.100 176.951 2.149 18755
2015 1 4 . 1 1 23 23 GLU CA C 23 58.515 58.515 56.917 1.598 18755
2016 1 4 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.228 -0.870 18755
2017 1 4 . 1 1 23 23 GLU H H 23 6.949 6.949 7.600 -0.651 18755
2018 1 4 . 1 1 24 24 GLN N N 24 118.007 118.007 116.060 1.947 18755
2019 1 4 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.544 -0.071 18755
2020 1 4 . 1 1 24 24 GLN C C 24 175.200 175.200 176.226 -1.026 18755
2021 1 4 . 1 1 24 24 GLN CA C 24 57.851 57.851 54.082 3.769 18755
2022 1 4 . 1 1 24 24 GLN CB C 24 29.025 29.025 29.035 -0.010 18755
2023 1 4 . 1 1 24 24 GLN H H 24 7.419 7.419 7.962 -0.542 18755
2024 1 4 . 1 1 25 25 GLU N N 25 114.406 114.406 122.965 -8.559 18755
2025 1 4 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.350 -0.054 18755
2026 1 4 . 1 1 25 25 GLU C C 25 175.500 175.500 175.290 0.210 18755
2027 1 4 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.422 -0.572 18755
2028 1 4 . 1 1 25 25 GLU CB C 25 29.660 29.660 28.260 1.400 18755
2029 1 4 . 1 1 25 25 GLU H H 25 7.148 7.148 8.264 -1.116 18755
2030 1 4 . 1 1 26 26 THR N N 26 116.297 116.297 118.310 -2.013 18755
2031 1 4 . 1 1 26 26 THR HA H 26 3.808 3.808 4.599 -0.791 18755
2032 1 4 . 1 1 26 26 THR C C 26 172.700 172.700 173.240 -0.540 18755
2033 1 4 . 1 1 26 26 THR CA C 26 64.750 64.750 61.441 3.309 18755
2034 1 4 . 1 1 26 26 THR CB C 26 69.899 69.899 70.316 -0.417 18755
2035 1 4 . 1 1 26 26 THR H H 26 7.178 7.178 8.258 -1.080 18755
2036 1 4 . 1 1 27 27 LEU N N 27 128.394 128.394 129.933 -1.539 18755
2037 1 4 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.418 0.356 18755
2038 1 4 . 1 1 27 27 LEU C C 27 176.600 176.600 175.495 1.105 18755
2039 1 4 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.743 -1.177 18755
2040 1 4 . 1 1 27 27 LEU CB C 27 42.977 42.977 43.305 -0.328 18755
2041 1 4 . 1 1 27 27 LEU H H 27 8.381 8.381 8.920 -0.539 18755
2042 1 4 . 1 1 28 28 VAL N N 28 117.407 117.407 121.695 -4.288 18755
2043 1 4 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.384 -0.276 18755
2044 1 4 . 1 1 28 28 VAL C C 28 173.600 173.600 174.818 -1.218 18755
2045 1 4 . 1 1 28 28 VAL CA C 28 58.968 58.968 58.651 0.317 18755
2046 1 4 . 1 1 28 28 VAL CB C 28 36.828 36.828 34.964 1.864 18755
2047 1 4 . 1 1 28 28 VAL H H 28 9.682 9.682 9.160 0.522 18755
2048 1 4 . 1 1 29 29 ARG N N 29 121.300 121.300 123.601 -2.301 18755
2049 1 4 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.754 0.482 18755
2050 1 4 . 1 1 29 29 ARG C C 29 174.700 174.700 174.067 0.633 18755
2051 1 4 . 1 1 29 29 ARG CA C 29 52.103 52.103 52.944 -0.841 18755
2052 1 4 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.298 0.821 18755
2053 1 4 . 1 1 29 29 ARG H H 29 9.164 9.164 8.479 0.685 18755
2054 1 4 . 1 1 33 33 LEU N N 33 118.497 118.497 119.449 -0.952 18755
2055 1 4 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.279 -0.216 18755
2056 1 4 . 1 1 33 33 LEU C C 33 178.140 178.140 178.662 -0.522 18755
2057 1 4 . 1 1 33 33 LEU CA C 33 57.855 57.855 56.405 1.450 18755
2058 1 4 . 1 1 33 33 LEU CB C 33 41.146 41.146 42.005 -0.859 18755
2059 1 4 . 1 1 33 33 LEU H H 33 8.807 8.807 8.435 0.372 18755
2060 1 4 . 1 1 34 34 LEU N N 34 118.106 118.106 120.716 -2.610 18755
2061 1 4 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.990 -0.063 18755
2062 1 4 . 1 1 34 34 LEU C C 34 177.700 177.700 178.768 -1.068 18755
2063 1 4 . 1 1 34 34 LEU CA C 34 56.526 56.526 57.983 -1.457 18755
2064 1 4 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.265 -0.864 18755
2065 1 4 . 1 1 34 34 LEU H H 34 7.298 7.298 7.674 -0.376 18755
2066 1 4 . 1 1 35 35 LEU N N 35 119.900 119.900 112.973 6.927 18755
2067 1 4 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.242 -0.560 18755
2068 1 4 . 1 1 35 35 LEU C C 35 177.500 177.500 178.897 -1.397 18755
2069 1 4 . 1 1 35 35 LEU CA C 35 57.820 57.820 56.821 0.999 18755
2070 1 4 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.304 0.953 18755
2071 1 4 . 1 1 35 35 LEU H H 35 8.521 8.521 8.276 0.245 18755
2072 1 4 . 1 1 36 36 LYS N N 36 118.000 118.000 119.947 -1.947 18755
2073 1 4 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.103 -0.376 18755
2074 1 4 . 1 1 36 36 LYS C C 36 179.100 179.100 178.590 0.510 18755
2075 1 4 . 1 1 36 36 LYS CA C 36 59.338 59.338 59.047 0.291 18755
2076 1 4 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.740 -0.828 18755
2077 1 4 . 1 1 36 36 LYS H H 36 7.824 7.824 8.286 -0.462 18755
2078 1 4 . 1 1 37 37 LEU N N 37 120.701 120.701 120.146 0.555 18755
2079 1 4 . 1 1 37 37 LEU HA H 37 3.668 3.668 4.166 -0.498 18755
2080 1 4 . 1 1 37 37 LEU C C 37 180.200 180.200 178.839 1.361 18755
2081 1 4 . 1 1 37 37 LEU CA C 37 59.088 59.088 58.224 0.865 18755
2082 1 4 . 1 1 37 37 LEU CB C 37 40.927 40.927 42.191 -1.264 18755
2083 1 4 . 1 1 37 37 LEU H H 37 7.230 7.230 7.543 -0.313 18755
2084 1 4 . 1 1 38 38 LEU N N 38 120.600 120.600 116.093 4.507 18755
2085 1 4 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.944 -0.484 18755
2086 1 4 . 1 1 38 38 LEU C C 38 178.900 178.900 178.667 0.233 18755
2087 1 4 . 1 1 38 38 LEU CA C 38 57.802 57.802 58.046 -0.244 18755
2088 1 4 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.831 -1.547 18755
2089 1 4 . 1 1 38 38 LEU H H 38 8.124 8.124 7.718 0.406 18755
2090 1 4 . 1 1 39 39 LYS N N 39 118.000 118.000 118.939 -0.939 18755
2091 1 4 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.105 0.058 18755
2092 1 4 . 1 1 39 39 LYS C C 39 180.108 180.108 177.584 2.524 18755
2093 1 4 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.722 0.283 18755
2094 1 4 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.268 -2.546 18755
2095 1 4 . 1 1 39 39 LYS H H 39 8.678 8.678 7.695 0.983 18755
2096 1 4 . 1 1 40 40 SER N N 40 116.993 116.993 113.395 3.598 18755
2097 1 4 . 1 1 40 40 SER HA H 40 4.269 4.269 4.279 -0.010 18755
2098 1 4 . 1 1 40 40 SER C C 40 175.000 175.000 175.686 -0.686 18755
2099 1 4 . 1 1 40 40 SER CA C 40 61.287 61.287 60.271 1.016 18755
2100 1 4 . 1 1 40 40 SER CB C 40 62.907 62.907 63.311 -0.404 18755
2101 1 4 . 1 1 40 40 SER H H 40 7.763 7.763 7.830 -0.067 18755
2102 1 4 . 1 1 41 41 VAL N N 41 112.903 112.903 117.458 -4.555 18755
2103 1 4 . 1 1 41 41 VAL HA H 41 4.667 4.667 3.985 0.682 18755
2104 1 4 . 1 1 41 41 VAL C C 41 175.300 175.300 176.867 -1.567 18755
2105 1 4 . 1 1 41 41 VAL CA C 41 60.235 60.235 62.642 -2.406 18755
2106 1 4 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.466 -1.851 18755
2107 1 4 . 1 1 41 41 VAL H H 41 7.143 7.143 7.444 -0.301 18755
2108 1 4 . 1 1 42 42 GLY N N 42 105.906 105.906 106.184 -0.278 18755
2109 1 4 . 1 1 42 42 GLY C C 42 174.300 174.300 173.519 0.781 18755
2110 1 4 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.904 0.228 18755
2111 1 4 . 1 1 42 42 GLY H H 42 7.354 7.354 7.507 -0.153 18755
2112 1 4 . 1 1 43 43 ALA N N 43 125.097 125.097 125.877 -0.780 18755
2113 1 4 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.595 0.306 18755
2114 1 4 . 1 1 43 43 ALA C C 43 177.900 177.900 177.335 0.565 18755
2115 1 4 . 1 1 43 43 ALA CA C 43 53.000 53.000 52.180 0.820 18755
2116 1 4 . 1 1 43 43 ALA CB C 43 18.064 18.064 16.984 1.080 18755
2117 1 4 . 1 1 43 43 ALA H H 43 7.246 7.246 7.869 -0.623 18755
2118 1 4 . 1 1 44 44 GLN N N 44 118.000 118.000 122.878 -4.878 18755
2119 1 4 . 1 1 44 44 GLN H H 44 8.676 8.676 8.104 0.572 18755
2120 1 4 . 1 1 45 45 LYS N N 45 117.985 117.985 121.452 -3.467 18755
2121 1 4 . 1 1 45 45 LYS H H 45 7.247 7.247 8.078 -0.831 18755
2122 1 4 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.347 0.114 18755
2123 1 4 . 1 1 46 46 ASP CA C 46 55.323 55.323 55.673 -0.350 18755
2124 1 4 . 1 1 47 47 THR N N 47 111.306 111.306 108.294 3.012 18755
2125 1 4 . 1 1 47 47 THR HA H 47 4.921 4.921 4.140 0.781 18755
2126 1 4 . 1 1 47 47 THR C C 47 171.900 171.900 172.592 -0.692 18755
2127 1 4 . 1 1 47 47 THR CA C 47 60.259 60.259 60.460 -0.201 18755
2128 1 4 . 1 1 47 47 THR CB C 47 71.478 71.478 71.234 0.244 18755
2129 1 4 . 1 1 47 47 THR H H 47 6.869 6.869 7.217 -0.348 18755
2130 1 4 . 1 1 48 48 TYR N N 48 119.895 119.895 119.417 0.478 18755
2131 1 4 . 1 1 48 48 TYR HA H 48 4.722 4.722 5.092 -0.370 18755
2132 1 4 . 1 1 48 48 TYR C C 48 175.700 175.700 175.993 -0.293 18755
2133 1 4 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.390 1.576 18755
2134 1 4 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.521 4.046 18755
2135 1 4 . 1 1 48 48 TYR H H 48 8.614 8.614 8.046 0.568 18755
2136 1 4 . 1 1 49 49 THR N N 49 110.720 110.720 113.163 -2.443 18755
2137 1 4 . 1 1 49 49 THR HA H 49 5.318 5.318 4.902 0.416 18755
2138 1 4 . 1 1 49 49 THR C C 49 178.400 178.400 176.310 2.090 18755
2139 1 4 . 1 1 49 49 THR CA C 49 61.019 61.019 59.987 1.032 18755
2140 1 4 . 1 1 49 49 THR CB C 49 71.104 71.104 71.062 0.042 18755
2141 1 4 . 1 1 49 49 THR H H 49 8.761 8.761 8.854 -0.093 18755
2142 1 4 . 1 1 50 50 MET N N 50 121.906 121.906 122.015 -0.109 18755
2143 1 4 . 1 1 50 50 MET HA H 50 4.196 4.196 4.156 0.040 18755
2144 1 4 . 1 1 50 50 MET C C 50 178.300 178.300 177.420 0.880 18755
2145 1 4 . 1 1 50 50 MET CA C 50 57.557 57.557 58.903 -1.345 18755
2146 1 4 . 1 1 50 50 MET CB C 50 30.037 30.037 32.424 -2.387 18755
2147 1 4 . 1 1 50 50 MET H H 50 7.901 7.901 9.003 -1.102 18755
2148 1 4 . 1 1 51 51 LYS N N 51 115.600 115.600 118.585 -2.985 18755
2149 1 4 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.230 0.055 18755
2150 1 4 . 1 1 51 51 LYS C C 51 179.100 179.100 179.034 0.066 18755
2151 1 4 . 1 1 51 51 LYS CA C 51 59.322 59.322 59.380 -0.058 18755
2152 1 4 . 1 1 51 51 LYS CB C 51 32.140 32.140 32.171 -0.031 18755
2153 1 4 . 1 1 51 51 LYS H H 51 8.413 8.413 7.592 0.821 18755
2154 1 4 . 1 1 52 52 GLU N N 52 120.906 120.906 120.174 0.732 18755
2155 1 4 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.802 0.601 18755
2156 1 4 . 1 1 52 52 GLU C C 52 178.200 178.200 178.321 -0.121 18755
2157 1 4 . 1 1 52 52 GLU CA C 52 58.778 58.778 58.907 -0.129 18755
2158 1 4 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.513 2.277 18755
2159 1 4 . 1 1 52 52 GLU H H 52 7.646 7.646 8.046 -0.400 18755
2160 1 4 . 1 1 53 53 VAL N N 53 120.300 120.300 119.919 0.381 18755
2161 1 4 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.740 -0.559 18755
2162 1 4 . 1 1 53 53 VAL C C 53 177.500 177.500 178.021 -0.521 18755
2163 1 4 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.750 0.675 18755
2164 1 4 . 1 1 53 53 VAL CB C 53 30.360 30.360 30.978 -0.618 18755
2165 1 4 . 1 1 53 53 VAL H H 53 7.972 7.972 8.337 -0.365 18755
2166 1 4 . 1 1 54 54 LEU N N 54 120.594 120.594 117.516 3.078 18755
2167 1 4 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.008 -0.324 18755
2168 1 4 . 1 1 54 54 LEU C C 54 178.900 178.900 179.062 -0.162 18755
2169 1 4 . 1 1 54 54 LEU CA C 54 55.110 55.110 57.037 -1.927 18755
2170 1 4 . 1 1 54 54 LEU CB C 54 39.237 39.237 39.818 -0.581 18755
2171 1 4 . 1 1 54 54 LEU H H 54 8.063 8.063 7.676 0.387 18755
2172 1 4 . 1 1 55 55 PHE N N 55 120.300 120.300 119.350 0.950 18755
2173 1 4 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.086 -0.135 18755
2174 1 4 . 1 1 55 55 PHE C C 55 177.900 177.900 177.471 0.429 18755
2175 1 4 . 1 1 55 55 PHE CA C 55 61.017 61.017 61.924 -0.907 18755
2176 1 4 . 1 1 55 55 PHE CB C 55 38.083 38.083 38.921 -0.838 18755
2177 1 4 . 1 1 55 55 PHE H H 55 7.339 7.339 7.391 -0.052 18755
2178 1 4 . 1 1 56 56 TYR N N 56 119.500 119.500 117.147 2.353 18755
2179 1 4 . 1 1 56 56 TYR HA H 56 3.740 3.740 3.966 -0.226 18755
2180 1 4 . 1 1 56 56 TYR C C 56 178.200 178.200 178.261 -0.061 18755
2181 1 4 . 1 1 56 56 TYR CA C 56 62.737 62.737 60.986 1.751 18755
2182 1 4 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.293 1.576 18755
2183 1 4 . 1 1 56 56 TYR H H 56 8.074 8.074 7.338 0.736 18755
2184 1 4 . 1 1 57 57 LEU N N 57 119.895 119.895 119.606 0.289 18755
2185 1 4 . 1 1 57 57 LEU HA H 57 3.858 3.858 4.201 -0.343 18755
2186 1 4 . 1 1 57 57 LEU C C 57 178.800 178.800 179.802 -1.002 18755
2187 1 4 . 1 1 57 57 LEU CA C 57 57.567 57.567 58.008 -0.441 18755
2188 1 4 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.414 0.744 18755
2189 1 4 . 1 1 57 57 LEU H H 57 8.628 8.628 8.291 0.337 18755
2190 1 4 . 1 1 58 58 GLY N N 58 107.015 107.015 106.927 0.088 18755
2191 1 4 . 1 1 58 58 GLY C C 58 175.028 175.028 175.915 -0.887 18755
2192 1 4 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.935 0.168 18755
2193 1 4 . 1 1 58 58 GLY H H 58 8.245 8.245 8.234 0.011 18755
2194 1 4 . 1 1 59 59 GLN N N 59 119.400 119.400 120.765 -1.365 18755
2195 1 4 . 1 1 59 59 GLN HA H 59 3.793 3.793 3.902 -0.109 18755
2196 1 4 . 1 1 59 59 GLN C C 59 178.900 178.900 177.275 1.625 18755
2197 1 4 . 1 1 59 59 GLN CA C 59 58.023 58.023 58.101 -0.078 18755
2198 1 4 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.608 0.275 18755
2199 1 4 . 1 1 59 59 GLN H H 59 7.400 7.400 8.252 -0.852 18755
2200 1 4 . 1 1 60 60 TYR N N 60 123.589 123.589 122.119 1.470 18755
2201 1 4 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.142 -0.455 18755
2202 1 4 . 1 1 60 60 TYR C C 60 175.700 175.700 177.508 -1.808 18755
2203 1 4 . 1 1 60 60 TYR CA C 60 62.621 62.621 59.975 2.646 18755
2204 1 4 . 1 1 60 60 TYR CB C 60 38.069 38.069 37.943 0.126 18755
2205 1 4 . 1 1 60 60 TYR H H 60 8.521 8.521 7.923 0.598 18755
2206 1 4 . 1 1 61 61 ILE N N 61 118.996 118.996 118.649 0.347 18755
2207 1 4 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.315 -0.190 18755
2208 1 4 . 1 1 61 61 ILE C C 61 177.600 177.600 177.997 -0.397 18755
2209 1 4 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.735 0.173 18755
2210 1 4 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.493 0.600 18755
2211 1 4 . 1 1 61 61 ILE H H 61 8.240 8.240 7.428 0.812 18755
2212 1 4 . 1 1 62 62 MET N N 62 115.500 115.500 117.222 -1.722 18755
2213 1 4 . 1 1 62 62 MET HA H 62 4.333 4.333 3.590 0.743 18755
2214 1 4 . 1 1 62 62 MET C C 62 180.000 180.000 177.821 2.179 18755
2215 1 4 . 1 1 62 62 MET CA C 62 57.270 57.270 58.616 -1.346 18755
2216 1 4 . 1 1 62 62 MET CB C 62 30.961 30.961 32.509 -1.548 18755
2217 1 4 . 1 1 62 62 MET H H 62 7.750 7.750 7.244 0.506 18755
2218 1 4 . 1 1 63 63 THR N N 63 117.070 117.070 112.102 4.968 18755
2219 1 4 . 1 1 63 63 THR HA H 63 3.865 3.865 4.162 -0.297 18755
2220 1 4 . 1 1 63 63 THR C C 63 176.200 176.200 176.076 0.124 18755
2221 1 4 . 1 1 63 63 THR CA C 63 65.992 65.992 64.661 1.331 18755
2222 1 4 . 1 1 63 63 THR CB C 63 68.857 68.857 69.144 -0.287 18755
2223 1 4 . 1 1 63 63 THR H H 63 8.423 8.423 7.901 0.522 18755
2224 1 4 . 1 1 64 64 LYS N N 64 118.512 118.512 119.114 -0.602 18755
2225 1 4 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.454 -0.500 18755
2226 1 4 . 1 1 64 64 LYS C C 64 174.500 174.500 176.181 -1.681 18755
2227 1 4 . 1 1 64 64 LYS CA C 64 55.027 55.027 55.571 -0.544 18755
2228 1 4 . 1 1 64 64 LYS CB C 64 30.673 30.673 33.342 -2.669 18755
2229 1 4 . 1 1 64 64 LYS H H 64 7.678 7.678 7.758 -0.080 18755
2230 1 4 . 1 1 65 65 ARG N N 65 115.400 115.400 116.493 -1.093 18755
2231 1 4 . 1 1 65 65 ARG HA H 65 3.764 3.764 4.072 -0.308 18755
2232 1 4 . 1 1 65 65 ARG C C 65 175.900 175.900 176.496 -0.596 18755
2233 1 4 . 1 1 65 65 ARG CA C 65 56.475 56.475 56.666 -0.191 18755
2234 1 4 . 1 1 65 65 ARG CB C 65 25.911 25.911 27.280 -1.369 18755
2235 1 4 . 1 1 65 65 ARG H H 65 7.467 7.467 8.034 -0.567 18755
2236 1 4 . 1 1 66 66 LEU N N 66 115.591 115.591 115.827 -0.236 18755
2237 1 4 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.233 0.102 18755
2238 1 4 . 1 1 66 66 LEU C C 66 175.400 175.400 177.049 -1.649 18755
2239 1 4 . 1 1 66 66 LEU CA C 66 54.526 54.526 54.894 -0.368 18755
2240 1 4 . 1 1 66 66 LEU CB C 66 41.682 41.682 41.229 0.453 18755
2241 1 4 . 1 1 66 66 LEU H H 66 7.612 7.612 7.967 -0.355 18755
2242 1 4 . 1 1 67 67 TYR N N 67 116.298 116.298 115.412 0.886 18755
2243 1 4 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.764 -0.013 18755
2244 1 4 . 1 1 67 67 TYR C C 67 173.576 173.576 174.665 -1.089 18755
2245 1 4 . 1 1 67 67 TYR CA C 67 55.334 55.334 53.650 1.684 18755
2246 1 4 . 1 1 67 67 TYR CB C 67 40.410 40.410 38.299 2.111 18755
2247 1 4 . 1 1 67 67 TYR H H 67 7.127 7.127 7.570 -0.443 18755
2248 1 4 . 1 1 68 68 ASP N N 68 124.792 124.792 126.023 -1.231 18755
2249 1 4 . 1 1 68 68 ASP C C 68 175.741 175.741 176.373 -0.632 18755
2250 1 4 . 1 1 68 68 ASP CA C 68 53.209 53.209 52.571 0.638 18755
2251 1 4 . 1 1 68 68 ASP CB C 68 42.503 42.503 40.433 2.070 18755
2252 1 4 . 1 1 68 68 ASP H H 68 8.205 8.205 8.906 -0.701 18755
2253 1 4 . 1 1 69 69 GLU N N 69 123.507 123.507 123.873 -0.366 18755
2254 1 4 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.353 -0.556 18755
2255 1 4 . 1 1 69 69 GLU C C 69 176.859 176.859 176.186 0.673 18755
2256 1 4 . 1 1 69 69 GLU CA C 69 57.980 57.980 55.629 2.351 18755
2257 1 4 . 1 1 69 69 GLU CB C 69 29.260 29.260 27.990 1.270 18755
2258 1 4 . 1 1 69 69 GLU H H 69 8.440 8.440 8.193 0.247 18755
2259 1 4 . 1 1 70 70 LYS N N 70 117.904 117.904 118.694 -0.790 18755
2260 1 4 . 1 1 70 70 LYS HA H 70 4.325 4.325 4.037 0.288 18755
2261 1 4 . 1 1 70 70 LYS C C 70 177.016 177.016 177.171 -0.155 18755
2262 1 4 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.624 -1.584 18755
2263 1 4 . 1 1 70 70 LYS CB C 70 32.090 32.090 32.566 -0.475 18755
2264 1 4 . 1 1 70 70 LYS H H 70 8.208 8.208 7.894 0.314 18755
2265 1 4 . 1 1 71 71 GLN N N 71 118.762 118.762 114.619 4.143 18755
2266 1 4 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.393 -0.068 18755
2267 1 4 . 1 1 71 71 GLN C C 71 175.300 175.300 176.462 -1.162 18755
2268 1 4 . 1 1 71 71 GLN CA C 71 54.920 54.920 56.188 -1.268 18755
2269 1 4 . 1 1 71 71 GLN CB C 71 28.850 28.850 29.010 -0.160 18755
2270 1 4 . 1 1 71 71 GLN H H 71 7.934 7.934 8.173 -0.239 18755
2271 1 4 . 1 1 72 72 GLN N N 72 118.200 118.200 119.089 -0.889 18755
2272 1 4 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.462 -0.427 18755
2273 1 4 . 1 1 72 72 GLN C C 72 175.022 175.022 176.134 -1.112 18755
2274 1 4 . 1 1 72 72 GLN CA C 72 57.210 57.210 54.503 2.707 18755
2275 1 4 . 1 1 72 72 GLN CB C 72 27.880 27.880 30.626 -2.746 18755
2276 1 4 . 1 1 72 72 GLN H H 72 8.051 8.051 7.964 0.087 18755
2277 1 4 . 1 1 74 74 ILE N N 74 120.607 120.607 120.870 -0.263 18755
2278 1 4 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.712 0.601 18755
2279 1 4 . 1 1 74 74 ILE C C 74 174.400 174.400 175.126 -0.726 18755
2280 1 4 . 1 1 74 74 ILE CA C 74 58.521 58.521 62.642 -4.121 18755
2281 1 4 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.004 -0.762 18755
2282 1 4 . 1 1 75 75 VAL N N 75 126.197 126.197 125.783 0.414 18755
2283 1 4 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.501 -0.741 18755
2284 1 4 . 1 1 75 75 VAL C C 75 174.100 174.100 173.521 0.579 18755
2285 1 4 . 1 1 75 75 VAL CA C 75 60.538 60.538 59.064 1.474 18755
2286 1 4 . 1 1 75 75 VAL CB C 75 31.759 31.759 34.264 -2.505 18755
2287 1 4 . 1 1 75 75 VAL H H 75 8.274 8.274 7.900 0.374 18755
2288 1 4 . 1 1 76 76 TYR N N 76 126.301 126.301 126.989 -0.688 18755
2289 1 4 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.474 -0.905 18755
2290 1 4 . 1 1 76 76 TYR C C 76 175.000 175.000 176.133 -1.133 18755
2291 1 4 . 1 1 76 76 TYR CA C 76 57.648 57.648 57.246 0.402 18755
2292 1 4 . 1 1 76 76 TYR CB C 76 38.188 38.188 41.079 -2.891 18755
2293 1 4 . 1 1 76 76 TYR H H 76 8.110 8.110 7.985 0.125 18755
2294 1 4 . 1 1 77 77 CYS N N 77 117.781 117.781 117.265 0.516 18755
2295 1 4 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.785 -0.003 18755
2296 1 4 . 1 1 77 77 CYS C C 77 173.429 173.429 173.768 -0.339 18755
2297 1 4 . 1 1 77 77 CYS CA C 77 55.361 55.361 56.722 -1.361 18755
2298 1 4 . 1 1 77 77 CYS CB C 77 29.255 29.255 31.013 -1.758 18755
2299 1 4 . 1 1 77 77 CYS H H 77 8.295 8.295 8.564 -0.269 18755
2300 1 4 . 1 1 78 78 SER N N 78 116.896 116.896 115.699 1.197 18755
2301 1 4 . 1 1 78 78 SER HA H 78 4.182 4.182 4.691 -0.509 18755
2302 1 4 . 1 1 78 78 SER CA C 78 60.064 60.064 57.053 3.011 18755
2303 1 4 . 1 1 78 78 SER CB C 78 63.122 63.122 65.383 -2.261 18755
2304 1 4 . 1 1 78 78 SER H H 78 7.585 7.585 8.380 -0.795 18755
2305 1 4 . 1 1 79 79 ASN N N 79 118.100 118.100 117.769 0.331 18755
2306 1 4 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.611 0.020 18755
2307 1 4 . 1 1 79 79 ASN C C 79 172.700 172.700 174.768 -2.068 18755
2308 1 4 . 1 1 79 79 ASN CA C 79 52.850 52.850 54.293 -1.443 18755
2309 1 4 . 1 1 79 79 ASN CB C 79 37.796 37.796 38.357 -0.561 18755
2310 1 4 . 1 1 79 79 ASN H H 79 8.609 8.609 8.599 0.010 18755
2311 1 4 . 1 1 80 80 ASP N N 80 118.603 118.603 118.162 0.441 18755
2312 1 4 . 1 1 80 80 ASP HA H 80 4.774 4.774 4.545 0.229 18755
2313 1 4 . 1 1 80 80 ASP C C 80 174.900 174.900 178.107 -3.207 18755
2314 1 4 . 1 1 80 80 ASP CA C 80 52.802 52.802 54.894 -2.092 18755
2315 1 4 . 1 1 80 80 ASP CB C 80 47.221 47.221 41.219 6.002 18755
2316 1 4 . 1 1 80 80 ASP H H 80 7.549 7.549 7.793 -0.244 18755
2317 1 4 . 1 1 81 81 LEU N N 81 129.094 129.094 118.785 10.309 18755
2318 1 4 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.375 -0.266 18755
2319 1 4 . 1 1 81 81 LEU C C 81 177.800 177.800 178.003 -0.203 18755
2320 1 4 . 1 1 81 81 LEU CA C 81 57.666 57.666 57.042 0.624 18755
2321 1 4 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.285 0.741 18755
2322 1 4 . 1 1 81 81 LEU H H 81 8.411 8.411 8.948 -0.537 18755
2323 1 4 . 1 1 82 82 LEU N N 82 118.601 118.601 121.716 -3.115 18755
2324 1 4 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.248 -0.784 18755
2325 1 4 . 1 1 82 82 LEU C C 82 178.100 178.100 178.436 -0.336 18755
2326 1 4 . 1 1 82 82 LEU CA C 82 57.811 57.811 55.903 1.908 18755
2327 1 4 . 1 1 82 82 LEU CB C 82 42.416 42.416 40.618 1.798 18755
2328 1 4 . 1 1 82 82 LEU H H 82 9.777 9.777 8.144 1.633 18755
2329 1 4 . 1 1 83 83 GLY N N 83 105.800 105.800 106.641 -0.841 18755
2330 1 4 . 1 1 83 83 GLY C C 83 176.900 176.900 175.112 1.788 18755
2331 1 4 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.586 0.968 18755
2332 1 4 . 1 1 83 83 GLY H H 83 7.592 7.592 7.816 -0.224 18755
2333 1 4 . 1 1 84 84 ASP N N 84 123.089 123.089 121.486 1.603 18755
2334 1 4 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.445 -0.163 18755
2335 1 4 . 1 1 84 84 ASP C C 84 178.600 178.600 177.200 1.400 18755
2336 1 4 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.755 -0.175 18755
2337 1 4 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.571 -0.676 18755
2338 1 4 . 1 1 84 84 ASP H H 84 7.366 7.366 8.310 -0.944 18755
2339 1 4 . 1 1 85 85 LEU N N 85 118.800 118.800 117.889 0.911 18755
2340 1 4 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.974 0.013 18755
2341 1 4 . 1 1 85 85 LEU C C 85 178.900 178.900 178.193 0.707 18755
2342 1 4 . 1 1 85 85 LEU CA C 85 56.984 56.984 56.812 0.172 18755
2343 1 4 . 1 1 85 85 LEU CB C 85 41.221 41.221 42.004 -0.783 18755
2344 1 4 . 1 1 85 85 LEU H H 85 7.981 7.981 7.358 0.623 18755
2345 1 4 . 1 1 86 86 PHE N N 86 117.812 117.812 115.526 2.286 18755
2346 1 4 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.225 0.177 18755
2347 1 4 . 1 1 86 86 PHE C C 86 176.400 176.400 177.281 -0.881 18755
2348 1 4 . 1 1 86 86 PHE CA C 86 55.833 55.833 59.422 -3.589 18755
2349 1 4 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.256 -1.928 18755
2350 1 4 . 1 1 86 86 PHE H H 86 8.531 8.531 7.345 1.186 18755
2351 1 4 . 1 1 87 87 GLY N N 87 107.899 107.899 107.232 0.667 18755
2352 1 4 . 1 1 87 87 GLY C C 87 173.800 173.800 173.856 -0.056 18755
2353 1 4 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.696 0.192 18755
2354 1 4 . 1 1 87 87 GLY H H 87 8.150 8.150 7.967 0.183 18755
2355 1 4 . 1 1 88 88 VAL N N 88 108.596 108.596 113.929 -5.333 18755
2356 1 4 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.763 0.134 18755
2357 1 4 . 1 1 88 88 VAL C C 88 174.100 174.100 174.214 -0.114 18755
2358 1 4 . 1 1 88 88 VAL CA C 88 56.703 56.703 57.989 -1.286 18755
2359 1 4 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.565 1.234 18755
2360 1 4 . 1 1 88 88 VAL H H 88 7.073 7.073 7.533 -0.460 18755
2361 1 4 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.686 -0.344 18755
2362 1 4 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.414 -1.534 18755
2363 1 4 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.265 -0.645 18755
2364 1 4 . 1 1 90 90 SER N N 90 110.799 110.799 114.655 -3.856 18755
2365 1 4 . 1 1 90 90 SER HA H 90 5.362 5.362 4.788 0.574 18755
2366 1 4 . 1 1 90 90 SER C C 90 172.300 172.300 173.251 -0.951 18755
2367 1 4 . 1 1 90 90 SER CA C 90 56.470 56.470 56.505 -0.035 18755
2368 1 4 . 1 1 90 90 SER CB C 90 64.481 64.481 64.681 -0.200 18755
2369 1 4 . 1 1 90 90 SER H H 90 7.115 7.115 7.569 -0.454 18755
2370 1 4 . 1 1 91 91 PHE N N 91 112.909 112.909 120.192 -7.283 18755
2371 1 4 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.795 -0.034 18755
2372 1 4 . 1 1 91 91 PHE C C 91 171.600 171.600 174.610 -3.010 18755
2373 1 4 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.141 1.408 18755
2374 1 4 . 1 1 91 91 PHE CB C 91 39.765 39.765 40.513 -0.748 18755
2375 1 4 . 1 1 91 91 PHE H H 91 8.008 8.008 8.525 -0.517 18755
2376 1 4 . 1 1 92 92 SER N N 92 113.293 113.293 119.656 -6.363 18755
2377 1 4 . 1 1 92 92 SER HA H 92 5.184 5.184 4.375 0.809 18755
2378 1 4 . 1 1 92 92 SER C C 92 177.900 177.900 175.799 2.101 18755
2379 1 4 . 1 1 92 92 SER CA C 92 55.256 55.256 58.291 -3.035 18755
2380 1 4 . 1 1 92 92 SER CB C 92 63.592 63.592 63.094 0.498 18755
2381 1 4 . 1 1 92 92 SER H H 92 8.708 8.708 8.668 0.040 18755
2382 1 4 . 1 1 93 93 VAL N N 93 121.309 121.309 126.821 -5.512 18755
2383 1 4 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.785 0.521 18755
2384 1 4 . 1 1 93 93 VAL C C 93 173.760 173.760 175.650 -1.890 18755
2385 1 4 . 1 1 93 93 VAL CA C 93 63.973 63.973 65.275 -1.302 18755
2386 1 4 . 1 1 93 93 VAL CB C 93 31.402 31.402 32.137 -0.735 18755
2387 1 4 . 1 1 93 93 VAL H H 93 8.879 8.879 8.085 0.794 18755
2388 1 4 . 1 1 94 94 LYS N N 94 113.118 113.118 114.054 -0.936 18755
2389 1 4 . 1 1 94 94 LYS HA H 94 4.380 4.380 3.854 0.526 18755
2390 1 4 . 1 1 94 94 LYS C C 94 177.300 177.300 177.216 0.084 18755
2391 1 4 . 1 1 94 94 LYS CA C 94 55.036 55.036 56.901 -1.865 18755
2392 1 4 . 1 1 94 94 LYS CB C 94 32.231 32.231 31.904 0.327 18755
2393 1 4 . 1 1 94 94 LYS H H 94 7.836 7.836 7.915 -0.079 18755
2394 1 4 . 1 1 95 95 GLU N N 95 119.700 119.700 120.533 -0.833 18755
2395 1 4 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.393 0.092 18755
2396 1 4 . 1 1 95 95 GLU C C 95 176.100 176.100 176.471 -0.371 18755
2397 1 4 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.960 -0.374 18755
2398 1 4 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.529 0.413 18755
2399 1 4 . 1 1 95 95 GLU H H 95 6.901 6.901 7.965 -1.064 18755
2400 1 4 . 1 1 96 96 HIS N N 96 121.512 121.512 120.959 0.553 18755
2401 1 4 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.145 0.212 18755
2402 1 4 . 1 1 96 96 HIS C C 96 177.300 177.300 177.068 0.232 18755
2403 1 4 . 1 1 96 96 HIS CA C 96 58.495 58.495 60.452 -1.957 18755
2404 1 4 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.521 1.444 18755
2405 1 4 . 1 1 96 96 HIS H H 96 7.568 7.568 6.959 0.609 18755
2406 1 4 . 1 1 97 97 ARG N N 97 120.300 120.300 119.034 1.266 18755
2407 1 4 . 1 1 97 97 ARG HA H 97 3.888 3.888 3.977 -0.089 18755
2408 1 4 . 1 1 97 97 ARG C C 97 177.800 177.800 177.667 0.133 18755
2409 1 4 . 1 1 97 97 ARG CA C 97 57.432 57.432 58.858 -1.427 18755
2410 1 4 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.502 -3.652 18755
2411 1 4 . 1 1 98 98 LYS N N 98 120.600 120.600 119.103 1.497 18755
2412 1 4 . 1 1 98 98 LYS C C 98 178.500 178.500 179.139 -0.639 18755
2413 1 4 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.579 0.491 18755
2414 1 4 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.700 -0.880 18755
2415 1 4 . 1 1 98 98 LYS H H 98 7.741 7.741 8.153 -0.412 18755
2416 1 4 . 1 1 99 99 ILE N N 99 119.394 119.394 118.899 0.495 18755
2417 1 4 . 1 1 99 99 ILE HA H 99 3.017 3.017 3.963 -0.946 18755
2418 1 4 . 1 1 99 99 ILE C C 99 177.000 177.000 178.286 -1.286 18755
2419 1 4 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.401 0.463 18755
2420 1 4 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.584 0.100 18755
2421 1 4 . 1 1 99 99 ILE H H 99 7.585 7.585 8.087 -0.502 18755
2422 1 4 . 1 1 100 100 TYR N N 100 121.894 121.894 120.475 1.419 18755
2423 1 4 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.204 -1.011 18755
2424 1 4 . 1 1 100 100 TYR C C 100 176.500 176.500 178.408 -1.908 18755
2425 1 4 . 1 1 100 100 TYR CA C 100 63.706 63.706 62.209 1.497 18755
2426 1 4 . 1 1 100 100 TYR CB C 100 37.142 37.142 37.746 -0.604 18755
2427 1 4 . 1 1 100 100 TYR H H 100 8.430 8.430 8.841 -0.411 18755
2428 1 4 . 1 1 101 101 THR N N 101 113.693 113.693 114.047 -0.354 18755
2429 1 4 . 1 1 101 101 THR HA H 101 3.805 3.805 4.015 -0.210 18755
2430 1 4 . 1 1 101 101 THR C C 101 176.100 176.100 175.613 0.487 18755
2431 1 4 . 1 1 101 101 THR CA C 101 67.003 67.003 66.194 0.809 18755
2432 1 4 . 1 1 101 101 THR CB C 101 68.496 68.496 68.695 -0.199 18755
2433 1 4 . 1 1 101 101 THR H H 101 8.232 8.232 8.058 0.174 18755
2434 1 4 . 1 1 102 102 MET N N 102 119.500 119.500 119.395 0.105 18755
2435 1 4 . 1 1 102 102 MET C C 102 178.000 178.000 178.152 -0.152 18755
2436 1 4 . 1 1 102 102 MET CA C 102 59.360 59.360 57.317 2.043 18755
2437 1 4 . 1 1 102 102 MET CB C 102 31.110 31.110 32.446 -1.336 18755
2438 1 4 . 1 1 102 102 MET H H 102 7.461 7.461 7.559 -0.098 18755
2439 1 4 . 1 1 103 103 ILE N N 103 120.103 120.103 120.102 0.001 18755
2440 1 4 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.535 -0.372 18755
2441 1 4 . 1 1 103 103 ILE C C 103 178.700 178.700 178.261 0.439 18755
2442 1 4 . 1 1 103 103 ILE CA C 103 66.114 66.114 65.164 0.950 18755
2443 1 4 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.732 -0.348 18755
2444 1 4 . 1 1 103 103 ILE H H 103 7.824 7.824 8.185 -0.361 18755
2445 1 4 . 1 1 104 104 TYR N N 104 119.500 119.500 118.528 0.972 18755
2446 1 4 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.298 -0.232 18755
2447 1 4 . 1 1 104 104 TYR C C 104 177.300 177.300 175.178 2.122 18755
2448 1 4 . 1 1 104 104 TYR CA C 104 60.505 60.505 59.851 0.654 18755
2449 1 4 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.466 -0.823 18755
2450 1 4 . 1 1 104 104 TYR H H 104 8.694 8.694 8.640 0.054 18755
2451 1 4 . 1 1 105 105 ARG N N 105 114.400 114.400 117.694 -3.294 18755
2452 1 4 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.194 0.043 18755
2453 1 4 . 1 1 105 105 ARG C C 105 176.500 176.500 176.157 0.343 18755
2454 1 4 . 1 1 105 105 ARG CA C 105 58.128 58.128 56.339 1.789 18755
2455 1 4 . 1 1 105 105 ARG CB C 105 30.266 30.266 31.270 -1.004 18755
2456 1 4 . 1 1 105 105 ARG H H 105 6.713 6.713 7.649 -0.936 18755
2457 1 4 . 1 1 106 106 ASN N N 106 116.011 116.011 118.904 -2.893 18755
2458 1 4 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.768 0.066 18755
2459 1 4 . 1 1 106 106 ASN C C 106 171.800 171.800 173.144 -1.344 18755
2460 1 4 . 1 1 106 106 ASN CA C 106 53.484 53.484 53.407 0.077 18755
2461 1 4 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.195 1.751 18755
2462 1 4 . 1 1 106 106 ASN H H 106 8.396 8.396 7.967 0.429 18755
2463 1 4 . 1 1 107 107 LEU N N 107 115.594 115.594 115.899 -0.305 18755
2464 1 4 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.856 -0.077 18755
2465 1 4 . 1 1 107 107 LEU C C 107 173.500 173.500 174.813 -1.313 18755
2466 1 4 . 1 1 107 107 LEU CA C 107 54.230 54.230 52.943 1.287 18755
2467 1 4 . 1 1 107 107 LEU CB C 107 45.490 45.490 44.220 1.270 18755
2468 1 4 . 1 1 107 107 LEU H H 107 7.551 7.551 7.245 0.306 18755
2469 1 4 . 1 1 108 108 VAL N N 108 117.493 117.493 123.084 -5.591 18755
2470 1 4 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.406 -0.092 18755
2471 1 4 . 1 1 108 108 VAL C C 108 175.100 175.100 174.606 0.494 18755
2472 1 4 . 1 1 108 108 VAL CA C 108 60.620 60.620 60.324 0.296 18755
2473 1 4 . 1 1 108 108 VAL CB C 108 34.322 34.322 32.325 1.997 18755
2474 1 4 . 1 1 108 108 VAL H H 108 7.906 7.906 8.612 -0.706 18755
2475 1 4 . 1 1 109 109 VAL N N 109 128.100 128.100 125.798 2.302 18755
2476 1 4 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.410 -0.431 18755
2477 1 4 . 1 1 109 109 VAL C C 109 176.000 176.000 175.458 0.542 18755
2478 1 4 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.478 0.841 18755
2479 1 4 . 1 1 109 109 VAL CB C 109 31.909 31.909 32.352 -0.443 18755
2480 1 4 . 1 1 109 109 VAL H H 109 8.740 8.740 8.502 0.238 18755
2481 1 4 . 1 1 110 110 VAL N N 110 127.704 127.704 123.185 4.519 18755
2482 1 4 . 1 1 110 110 VAL HA H 110 3.785 3.785 4.184 -0.399 18755
2483 1 4 . 1 1 110 110 VAL C C 110 175.300 175.300 176.483 -1.183 18755
2484 1 4 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.504 -0.614 18755
2485 1 4 . 1 1 110 110 VAL H H 110 8.283 8.283 8.700 -0.417 18755
2486 1 4 . 1 1 111 111 ASN N N 111 122.500 122.500 117.971 4.529 18755
2487 1 4 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.935 -0.309 18755
2488 1 4 . 1 1 111 111 ASN C C 111 174.728 174.728 173.584 1.144 18755
2489 1 4 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.923 -0.105 18755
2490 1 4 . 1 1 111 111 ASN CB C 111 38.664 38.664 40.771 -2.107 18755
2491 1 4 . 1 1 111 111 ASN H H 111 8.488 8.488 8.303 0.185 18755
2492 1 4 . 1 1 112 112 GLN N N 112 121.700 121.700 119.850 1.850 18755
2493 1 4 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.700 -0.506 18755
2494 1 4 . 1 1 112 112 GLN C C 112 175.600 175.600 175.468 0.132 18755
2495 1 4 . 1 1 112 112 GLN CA C 112 55.958 55.958 55.069 0.889 18755
2496 1 4 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.081 -1.106 18755
2497 1 4 . 1 1 112 112 GLN H H 112 8.366 8.366 8.415 -0.049 18755
2498 1 4 . 1 1 113 113 GLN N N 113 122.200 122.200 120.113 2.087 18755
2499 1 4 . 1 1 113 113 GLN C C 113 176.200 176.200 175.126 1.074 18755
2500 1 4 . 1 1 113 113 GLN CA C 113 56.500 56.500 56.548 -0.048 18755
2501 1 4 . 1 1 113 113 GLN CB C 113 30.030 30.030 29.620 0.410 18755
2502 1 4 . 1 1 113 113 GLN H H 113 8.331 8.331 8.636 -0.305 18755
2503 1 4 . 1 1 115 115 SER N N 115 116.889 116.889 115.699 1.190 18755
2504 1 4 . 1 1 115 115 SER HA H 115 4.392 4.392 4.597 -0.205 18755
2505 1 4 . 1 1 115 115 SER C C 115 174.412 174.412 175.234 -0.822 18755
2506 1 4 . 1 1 115 115 SER CA C 115 57.837 57.837 58.934 -1.097 18755
2507 1 4 . 1 1 115 115 SER CB C 115 63.574 63.574 64.096 -0.522 18755
2508 1 4 . 1 1 115 115 SER H H 115 8.302 8.302 8.694 -0.392 18755
2509 1 4 . 1 1 116 116 SER N N 116 118.000 118.000 115.388 2.612 18755
2510 1 4 . 1 1 116 116 SER HA H 116 4.381 4.381 4.586 -0.205 18755
2511 1 4 . 1 1 116 116 SER C C 116 174.100 174.100 173.189 0.911 18755
2512 1 4 . 1 1 116 116 SER CA C 116 58.062 58.062 57.113 0.949 18755
2513 1 4 . 1 1 116 116 SER CB C 116 63.460 63.460 64.389 -0.929 18755
2514 1 4 . 1 1 116 116 SER H H 116 8.350 8.350 7.759 0.591 18755
2515 1 4 . 1 1 117 117 ASP N N 117 122.400 122.400 121.511 0.889 18755
2516 1 4 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.592 -0.041 18755
2517 1 4 . 1 1 117 117 ASP C C 117 176.200 176.200 175.510 0.690 18755
2518 1 4 . 1 1 117 117 ASP CA C 117 54.140 54.140 55.083 -0.943 18755
2519 1 4 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.129 -0.149 18755
2520 1 4 . 1 1 117 117 ASP H H 117 8.274 8.274 8.389 -0.115 18755
2521 1 4 . 1 1 118 118 SER N N 118 116.593 116.593 120.196 -3.603 18755
2522 1 4 . 1 1 118 118 SER HA H 118 4.296 4.296 4.684 -0.388 18755
2523 1 4 . 1 1 118 118 SER C C 118 175.000 175.000 174.796 0.204 18755
2524 1 4 . 1 1 118 118 SER CA C 118 58.660 58.660 57.449 1.211 18755
2525 1 4 . 1 1 118 118 SER CB C 118 63.550 63.550 64.102 -0.552 18755
2526 1 4 . 1 1 118 118 SER H H 118 8.210 8.210 8.422 -0.212 18755
2527 1 4 . 1 1 119 119 GLY N N 119 110.896 110.896 112.307 -1.411 18755
2528 1 4 . 1 1 119 119 GLY C C 119 174.100 174.100 174.439 -0.339 18755
2529 1 4 . 1 1 119 119 GLY CA C 119 45.180 45.180 46.207 -1.027 18755
2530 1 4 . 1 1 119 119 GLY H H 119 8.376 8.376 8.736 -0.360 18755
2531 1 4 . 1 1 120 120 THR N N 120 113.503 113.503 111.717 1.786 18755
2532 1 4 . 1 1 120 120 THR HA H 120 4.255 4.255 4.418 -0.163 18755
2533 1 4 . 1 1 120 120 THR C C 120 174.385 174.385 173.451 0.934 18755
2534 1 4 . 1 1 120 120 THR CA C 120 61.490 61.490 60.704 0.786 18755
2535 1 4 . 1 1 120 120 THR CB C 120 69.690 69.690 71.196 -1.506 18755
2536 1 4 . 1 1 120 120 THR H H 120 7.932 7.932 7.552 0.380 18755
2537 1 4 . 1 1 121 121 SER N N 121 118.800 118.800 114.939 3.861 18755
2538 1 4 . 1 1 121 121 SER HA H 121 4.354 4.354 4.665 -0.311 18755
2539 1 4 . 1 1 121 121 SER C C 121 174.120 174.120 173.993 0.127 18755
2540 1 4 . 1 1 121 121 SER CA C 121 57.876 57.876 57.708 0.168 18755
2541 1 4 . 1 1 121 121 SER CB C 121 63.650 63.650 64.133 -0.483 18755
2542 1 4 . 1 1 121 121 SER H H 121 8.284 8.284 8.138 0.146 18755
2543 1 4 . 1 1 122 122 VAL N N 122 121.801 121.801 121.088 0.713 18755
2544 1 4 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.418 -0.348 18755
2545 1 4 . 1 1 122 122 VAL C C 122 175.900 175.900 175.034 0.866 18755
2546 1 4 . 1 1 122 122 VAL CA C 122 61.859 61.859 61.360 0.499 18755
2547 1 4 . 1 1 122 122 VAL CB C 122 32.315 32.315 34.225 -1.910 18755
2548 1 4 . 1 1 122 122 VAL H H 122 8.131 8.131 8.477 -0.346 18755
2549 1 4 . 1 1 123 123 SER N N 123 119.593 119.593 122.748 -3.155 18755
2550 1 4 . 1 1 123 123 SER HA H 123 4.331 4.331 4.735 -0.404 18755
2551 1 4 . 1 1 123 123 SER C C 123 174.000 174.000 173.923 0.077 18755
2552 1 4 . 1 1 123 123 SER CA C 123 57.780 57.780 57.853 -0.073 18755
2553 1 4 . 1 1 123 123 SER CB C 123 63.720 63.720 65.813 -2.093 18755
2554 1 4 . 1 1 123 123 SER H H 123 8.277 8.277 8.513 -0.236 18755
2555 1 4 . 1 1 124 124 GLU N N 124 123.501 123.501 120.292 3.209 18755
2556 1 4 . 1 1 124 124 GLU HA H 124 4.186 4.186 4.401 -0.215 18755
2557 1 4 . 1 1 124 124 GLU C C 124 175.060 175.060 176.068 -1.008 18755
2558 1 4 . 1 1 124 124 GLU CA C 124 56.200 56.200 56.634 -0.434 18755
2559 1 4 . 1 1 124 124 GLU CB C 124 30.270 30.270 30.002 0.268 18755
2560 1 4 . 1 1 124 124 GLU H H 124 8.378 8.378 8.837 -0.459 18755
2561 1 5 . 1 1 2 2 CYS N N 2 123.192 123.192 119.109 4.083 18755
2562 1 5 . 1 1 2 2 CYS H H 2 8.252 8.252 8.374 -0.122 18755
2563 1 5 . 1 1 3 3 ASN N N 3 123.749 123.749 123.880 -0.131 18755
2564 1 5 . 1 1 3 3 ASN H H 3 8.128 8.128 8.798 -0.670 18755
2565 1 5 . 1 1 6 6 MET N N 6 119.009 119.009 120.678 -1.669 18755
2566 1 5 . 1 1 6 6 MET CA C 6 43.265 43.265 53.448 -10.183 18755
2567 1 5 . 1 1 6 6 MET CB C 6 27.431 27.431 34.724 -7.293 18755
2568 1 5 . 1 1 6 6 MET H H 6 7.099 7.099 8.562 -1.462 18755
2569 1 5 . 1 1 7 7 SER N N 7 119.000 119.000 115.934 3.066 18755
2570 1 5 . 1 1 7 7 SER HA H 7 4.337 4.337 4.327 0.010 18755
2571 1 5 . 1 1 7 7 SER C C 7 177.600 177.600 174.534 3.066 18755
2572 1 5 . 1 1 7 7 SER CA C 7 57.850 57.850 58.790 -0.940 18755
2573 1 5 . 1 1 7 7 SER CB C 7 63.720 63.720 63.195 0.525 18755
2574 1 5 . 1 1 7 7 SER H H 7 8.246 8.246 8.472 -0.226 18755
2575 1 5 . 1 1 8 8 VAL N N 8 126.800 126.800 119.620 7.180 18755
2576 1 5 . 1 1 8 8 VAL HA H 8 4.290 4.290 3.854 0.436 18755
2577 1 5 . 1 1 8 8 VAL C C 8 180.600 180.600 174.824 5.776 18755
2578 1 5 . 1 1 8 8 VAL CA C 8 55.790 55.790 62.007 -6.217 18755
2579 1 5 . 1 1 8 8 VAL CB C 8 41.860 41.860 30.281 11.579 18755
2580 1 5 . 1 1 8 8 VAL H H 8 7.988 7.988 8.587 -0.599 18755
2581 1 5 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.665 -0.314 18755
2582 1 5 . 1 1 9 9 PRO C C 9 176.757 176.757 176.973 -0.216 18755
2583 1 5 . 1 1 10 10 THR N N 10 113.463 113.463 114.195 -0.732 18755
2584 1 5 . 1 1 10 10 THR HA H 10 4.235 4.235 4.480 -0.245 18755
2585 1 5 . 1 1 10 10 THR C C 10 174.000 174.000 174.343 -0.343 18755
2586 1 5 . 1 1 10 10 THR CA C 10 61.265 61.265 63.788 -2.522 18755
2587 1 5 . 1 1 10 10 THR CB C 10 69.466 69.466 69.653 -0.187 18755
2588 1 5 . 1 1 10 10 THR H H 10 8.109 8.109 8.759 -0.650 18755
2589 1 5 . 1 1 11 11 ASP N N 11 122.009 122.009 120.293 1.716 18755
2590 1 5 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.724 -0.301 18755
2591 1 5 . 1 1 11 11 ASP C C 11 175.900 175.900 176.583 -0.683 18755
2592 1 5 . 1 1 11 11 ASP CA C 11 54.245 54.245 53.853 0.392 18755
2593 1 5 . 1 1 11 11 ASP CB C 11 40.957 40.957 42.490 -1.533 18755
2594 1 5 . 1 1 11 11 ASP H H 11 8.180 8.180 8.361 -0.181 18755
2595 1 5 . 1 1 12 12 GLY N N 12 108.549 108.549 108.276 0.273 18755
2596 1 5 . 1 1 12 12 GLY C C 12 171.700 171.700 171.949 -0.249 18755
2597 1 5 . 1 1 12 12 GLY CA C 12 44.481 44.481 45.234 -0.753 18755
2598 1 5 . 1 1 12 12 GLY H H 12 7.409 7.409 7.751 -0.342 18755
2599 1 5 . 1 1 13 13 ALA N N 13 119.600 119.600 119.754 -0.154 18755
2600 1 5 . 1 1 13 13 ALA HA H 13 4.302 4.302 3.208 1.094 18755
2601 1 5 . 1 1 13 13 ALA C C 13 176.400 176.400 173.938 2.462 18755
2602 1 5 . 1 1 13 13 ALA CA C 13 51.676 51.676 50.866 0.810 18755
2603 1 5 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.344 0.302 18755
2604 1 5 . 1 1 13 13 ALA H H 13 7.288 7.288 7.151 0.137 18755
2605 1 5 . 1 1 14 14 VAL N N 14 118.098 118.098 117.615 0.483 18755
2606 1 5 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.256 0.292 18755
2607 1 5 . 1 1 14 14 VAL C C 14 174.300 174.300 174.445 -0.145 18755
2608 1 5 . 1 1 14 14 VAL CA C 14 60.637 60.637 61.294 -0.657 18755
2609 1 5 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.474 0.699 18755
2610 1 5 . 1 1 14 14 VAL H H 14 8.091 8.091 8.281 -0.190 18755
2611 1 5 . 1 1 15 15 THR N N 15 116.900 116.900 114.760 2.140 18755
2612 1 5 . 1 1 15 15 THR HA H 15 4.750 4.750 4.582 0.168 18755
2613 1 5 . 1 1 15 15 THR C C 15 173.364 173.364 173.184 0.180 18755
2614 1 5 . 1 1 15 15 THR CA C 15 60.011 60.011 61.339 -1.328 18755
2615 1 5 . 1 1 15 15 THR CB C 15 71.125 71.125 71.286 -0.161 18755
2616 1 5 . 1 1 15 15 THR H H 15 8.303 8.303 8.339 -0.036 18755
2617 1 5 . 1 1 16 16 THR N N 16 116.004 116.004 117.075 -1.071 18755
2618 1 5 . 1 1 16 16 THR HA H 16 4.678 4.678 4.105 0.573 18755
2619 1 5 . 1 1 16 16 THR C C 16 173.665 173.665 173.577 0.088 18755
2620 1 5 . 1 1 16 16 THR CA C 16 57.028 57.028 60.682 -3.654 18755
2621 1 5 . 1 1 16 16 THR CB C 16 67.263 67.263 71.262 -3.999 18755
2622 1 5 . 1 1 16 16 THR H H 16 8.352 8.352 8.154 0.198 18755
2623 1 5 . 1 1 17 17 SER N N 17 121.926 121.926 116.420 5.506 18755
2624 1 5 . 1 1 17 17 SER HA H 17 4.440 4.440 4.689 -0.249 18755
2625 1 5 . 1 1 17 17 SER CA C 17 58.639 58.639 59.198 -0.559 18755
2626 1 5 . 1 1 17 17 SER CB C 17 63.087 63.087 64.497 -1.410 18755
2627 1 5 . 1 1 17 17 SER H H 17 8.566 8.566 8.874 -0.308 18755
2628 1 5 . 1 1 18 18 GLN N N 18 121.238 121.238 118.657 2.581 18755
2629 1 5 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.348 -0.400 18755
2630 1 5 . 1 1 18 18 GLN C C 18 174.237 174.237 174.650 -0.413 18755
2631 1 5 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.259 0.226 18755
2632 1 5 . 1 1 18 18 GLN CB C 18 29.687 29.687 30.251 -0.564 18755
2633 1 5 . 1 1 18 18 GLN H H 18 9.115 9.115 8.394 0.721 18755
2634 1 5 . 1 1 19 19 ILE N N 19 117.894 117.894 114.568 3.326 18755
2635 1 5 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.615 -0.285 18755
2636 1 5 . 1 1 19 19 ILE C C 19 173.200 173.200 172.870 0.330 18755
2637 1 5 . 1 1 19 19 ILE CA C 19 54.716 54.716 58.719 -4.003 18755
2638 1 5 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.138 1.920 18755
2639 1 5 . 1 1 19 19 ILE H H 19 6.487 6.487 7.799 -1.312 18755
2640 1 5 . 1 1 21 21 ALA N N 21 128.900 128.900 120.991 7.909 18755
2641 1 5 . 1 1 21 21 ALA HA H 21 3.890 3.890 4.008 -0.118 18755
2642 1 5 . 1 1 21 21 ALA C C 21 180.600 180.600 179.503 1.097 18755
2643 1 5 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.491 0.417 18755
2644 1 5 . 1 1 21 21 ALA CB C 21 17.767 17.767 18.194 -0.427 18755
2645 1 5 . 1 1 21 21 ALA H H 21 8.867 8.867 8.736 0.131 18755
2646 1 5 . 1 1 22 22 SER N N 22 111.315 111.315 112.320 -1.005 18755
2647 1 5 . 1 1 22 22 SER HA H 22 3.787 3.787 4.416 -0.629 18755
2648 1 5 . 1 1 22 22 SER C C 22 178.400 178.400 175.606 2.794 18755
2649 1 5 . 1 1 22 22 SER CA C 22 61.138 61.138 60.727 0.411 18755
2650 1 5 . 1 1 22 22 SER CB C 22 60.854 60.854 62.620 -1.766 18755
2651 1 5 . 1 1 22 22 SER H H 22 8.752 8.752 8.435 0.317 18755
2652 1 5 . 1 1 23 23 GLU N N 23 122.700 122.700 119.442 3.258 18755
2653 1 5 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.437 -0.429 18755
2654 1 5 . 1 1 23 23 GLU C C 23 179.100 179.100 177.058 2.042 18755
2655 1 5 . 1 1 23 23 GLU CA C 23 58.515 58.515 57.265 1.250 18755
2656 1 5 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.455 -1.097 18755
2657 1 5 . 1 1 23 23 GLU H H 23 6.949 6.949 7.751 -0.802 18755
2658 1 5 . 1 1 24 24 GLN N N 24 118.007 118.007 117.783 0.224 18755
2659 1 5 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.593 -0.120 18755
2660 1 5 . 1 1 24 24 GLN C C 24 175.200 175.200 175.648 -0.448 18755
2661 1 5 . 1 1 24 24 GLN CA C 24 57.851 57.851 55.460 2.391 18755
2662 1 5 . 1 1 24 24 GLN CB C 24 29.025 29.025 29.322 -0.297 18755
2663 1 5 . 1 1 24 24 GLN H H 24 7.419 7.419 8.241 -0.822 18755
2664 1 5 . 1 1 25 25 GLU N N 25 114.406 114.406 121.654 -7.248 18755
2665 1 5 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.259 0.037 18755
2666 1 5 . 1 1 25 25 GLU C C 25 175.500 175.500 175.671 -0.171 18755
2667 1 5 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.907 -1.057 18755
2668 1 5 . 1 1 25 25 GLU CB C 25 29.660 29.660 28.013 1.647 18755
2669 1 5 . 1 1 25 25 GLU H H 25 7.148 7.148 8.215 -1.067 18755
2670 1 5 . 1 1 26 26 THR N N 26 116.297 116.297 117.885 -1.588 18755
2671 1 5 . 1 1 26 26 THR HA H 26 3.808 3.808 4.626 -0.818 18755
2672 1 5 . 1 1 26 26 THR C C 26 172.700 172.700 173.296 -0.596 18755
2673 1 5 . 1 1 26 26 THR CA C 26 64.750 64.750 61.629 3.121 18755
2674 1 5 . 1 1 26 26 THR CB C 26 69.899 69.899 70.658 -0.759 18755
2675 1 5 . 1 1 26 26 THR H H 26 7.178 7.178 8.134 -0.956 18755
2676 1 5 . 1 1 27 27 LEU N N 27 128.394 128.394 130.109 -1.715 18755
2677 1 5 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.358 0.416 18755
2678 1 5 . 1 1 27 27 LEU C C 27 176.600 176.600 175.431 1.169 18755
2679 1 5 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.969 -1.403 18755
2680 1 5 . 1 1 27 27 LEU CB C 27 42.977 42.977 43.240 -0.263 18755
2681 1 5 . 1 1 27 27 LEU H H 27 8.381 8.381 8.915 -0.534 18755
2682 1 5 . 1 1 28 28 VAL N N 28 117.407 117.407 120.949 -3.542 18755
2683 1 5 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.424 -0.316 18755
2684 1 5 . 1 1 28 28 VAL C C 28 173.600 173.600 174.672 -1.072 18755
2685 1 5 . 1 1 28 28 VAL CA C 28 58.968 58.968 58.434 0.534 18755
2686 1 5 . 1 1 28 28 VAL CB C 28 36.828 36.828 35.179 1.649 18755
2687 1 5 . 1 1 28 28 VAL H H 28 9.682 9.682 9.135 0.547 18755
2688 1 5 . 1 1 29 29 ARG N N 29 121.300 121.300 124.344 -3.044 18755
2689 1 5 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.753 0.483 18755
2690 1 5 . 1 1 29 29 ARG C C 29 174.700 174.700 173.982 0.718 18755
2691 1 5 . 1 1 29 29 ARG CA C 29 52.103 52.103 52.737 -0.634 18755
2692 1 5 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.675 0.444 18755
2693 1 5 . 1 1 29 29 ARG H H 29 9.164 9.164 8.164 1.000 18755
2694 1 5 . 1 1 33 33 LEU N N 33 118.497 118.497 120.474 -1.977 18755
2695 1 5 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.203 -0.140 18755
2696 1 5 . 1 1 33 33 LEU C C 33 178.140 178.140 178.421 -0.281 18755
2697 1 5 . 1 1 33 33 LEU CA C 33 57.855 57.855 56.889 0.966 18755
2698 1 5 . 1 1 33 33 LEU CB C 33 41.146 41.146 41.599 -0.453 18755
2699 1 5 . 1 1 33 33 LEU H H 33 8.807 8.807 8.505 0.302 18755
2700 1 5 . 1 1 34 34 LEU N N 34 118.106 118.106 120.765 -2.659 18755
2701 1 5 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.914 0.013 18755
2702 1 5 . 1 1 34 34 LEU C C 34 177.700 177.700 178.643 -0.943 18755
2703 1 5 . 1 1 34 34 LEU CA C 34 56.526 56.526 57.802 -1.276 18755
2704 1 5 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.189 -0.788 18755
2705 1 5 . 1 1 34 34 LEU H H 34 7.298 7.298 7.545 -0.247 18755
2706 1 5 . 1 1 35 35 LEU N N 35 119.900 119.900 113.625 6.275 18755
2707 1 5 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.063 -0.381 18755
2708 1 5 . 1 1 35 35 LEU C C 35 177.500 177.500 178.941 -1.441 18755
2709 1 5 . 1 1 35 35 LEU CA C 35 57.820 57.820 57.168 0.652 18755
2710 1 5 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.254 1.003 18755
2711 1 5 . 1 1 35 35 LEU H H 35 8.521 8.521 8.214 0.307 18755
2712 1 5 . 1 1 36 36 LYS N N 36 118.000 118.000 119.256 -1.256 18755
2713 1 5 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.068 -0.341 18755
2714 1 5 . 1 1 36 36 LYS C C 36 179.100 179.100 178.276 0.824 18755
2715 1 5 . 1 1 36 36 LYS CA C 36 59.338 59.338 58.876 0.462 18755
2716 1 5 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.837 -0.926 18755
2717 1 5 . 1 1 36 36 LYS H H 36 7.824 7.824 8.126 -0.302 18755
2718 1 5 . 1 1 37 37 LEU N N 37 120.701 120.701 120.860 -0.159 18755
2719 1 5 . 1 1 37 37 LEU HA H 37 3.668 3.668 3.994 -0.326 18755
2720 1 5 . 1 1 37 37 LEU C C 37 180.200 180.200 178.470 1.730 18755
2721 1 5 . 1 1 37 37 LEU CA C 37 59.088 59.088 58.205 0.883 18755
2722 1 5 . 1 1 37 37 LEU CB C 37 40.927 40.927 41.440 -0.513 18755
2723 1 5 . 1 1 37 37 LEU H H 37 7.230 7.230 7.537 -0.307 18755
2724 1 5 . 1 1 38 38 LEU N N 38 120.600 120.600 116.660 3.940 18755
2725 1 5 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.697 -0.237 18755
2726 1 5 . 1 1 38 38 LEU C C 38 178.900 178.900 178.701 0.199 18755
2727 1 5 . 1 1 38 38 LEU CA C 38 57.802 57.802 57.986 -0.184 18755
2728 1 5 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.442 -1.158 18755
2729 1 5 . 1 1 38 38 LEU H H 38 8.124 8.124 7.532 0.592 18755
2730 1 5 . 1 1 39 39 LYS N N 39 118.000 118.000 119.488 -1.488 18755
2731 1 5 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.035 0.128 18755
2732 1 5 . 1 1 39 39 LYS C C 39 180.108 180.108 177.868 2.240 18755
2733 1 5 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.631 0.374 18755
2734 1 5 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.092 -2.370 18755
2735 1 5 . 1 1 39 39 LYS H H 39 8.678 8.678 7.663 1.015 18755
2736 1 5 . 1 1 40 40 SER N N 40 116.993 116.993 112.028 4.965 18755
2737 1 5 . 1 1 40 40 SER HA H 40 4.269 4.269 4.319 -0.050 18755
2738 1 5 . 1 1 40 40 SER C C 40 175.000 175.000 175.883 -0.883 18755
2739 1 5 . 1 1 40 40 SER CA C 40 61.287 61.287 60.414 0.873 18755
2740 1 5 . 1 1 40 40 SER CB C 40 62.907 62.907 63.631 -0.724 18755
2741 1 5 . 1 1 40 40 SER H H 40 7.763 7.763 8.065 -0.302 18755
2742 1 5 . 1 1 41 41 VAL N N 41 112.903 112.903 117.117 -4.214 18755
2743 1 5 . 1 1 41 41 VAL HA H 41 4.667 4.667 4.184 0.483 18755
2744 1 5 . 1 1 41 41 VAL C C 41 175.300 175.300 176.893 -1.593 18755
2745 1 5 . 1 1 41 41 VAL CA C 41 60.235 60.235 62.708 -2.473 18755
2746 1 5 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.068 -1.453 18755
2747 1 5 . 1 1 41 41 VAL H H 41 7.143 7.143 7.383 -0.240 18755
2748 1 5 . 1 1 42 42 GLY N N 42 105.906 105.906 106.650 -0.744 18755
2749 1 5 . 1 1 42 42 GLY C C 42 174.300 174.300 173.605 0.695 18755
2750 1 5 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.875 0.257 18755
2751 1 5 . 1 1 42 42 GLY H H 42 7.354 7.354 7.489 -0.135 18755
2752 1 5 . 1 1 43 43 ALA N N 43 125.097 125.097 124.778 0.319 18755
2753 1 5 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.571 0.330 18755
2754 1 5 . 1 1 43 43 ALA C C 43 177.900 177.900 176.671 1.229 18755
2755 1 5 . 1 1 43 43 ALA CA C 43 53.000 53.000 52.300 0.701 18755
2756 1 5 . 1 1 43 43 ALA CB C 43 18.064 18.064 16.970 1.094 18755
2757 1 5 . 1 1 43 43 ALA H H 43 7.246 7.246 7.876 -0.630 18755
2758 1 5 . 1 1 44 44 GLN N N 44 118.000 118.000 123.493 -5.493 18755
2759 1 5 . 1 1 44 44 GLN H H 44 8.676 8.676 8.500 0.176 18755
2760 1 5 . 1 1 45 45 LYS N N 45 117.985 117.985 120.689 -2.704 18755
2761 1 5 . 1 1 45 45 LYS H H 45 7.247 7.247 7.761 -0.514 18755
2762 1 5 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.301 0.160 18755
2763 1 5 . 1 1 46 46 ASP CA C 46 55.323 55.323 56.103 -0.780 18755
2764 1 5 . 1 1 47 47 THR N N 47 111.306 111.306 110.012 1.294 18755
2765 1 5 . 1 1 47 47 THR HA H 47 4.921 4.921 4.189 0.732 18755
2766 1 5 . 1 1 47 47 THR C C 47 171.900 171.900 172.534 -0.634 18755
2767 1 5 . 1 1 47 47 THR CA C 47 60.259 60.259 60.517 -0.258 18755
2768 1 5 . 1 1 47 47 THR CB C 47 71.478 71.478 71.066 0.412 18755
2769 1 5 . 1 1 47 47 THR H H 47 6.869 6.869 7.345 -0.476 18755
2770 1 5 . 1 1 48 48 TYR N N 48 119.895 119.895 120.245 -0.350 18755
2771 1 5 . 1 1 48 48 TYR HA H 48 4.722 4.722 4.986 -0.264 18755
2772 1 5 . 1 1 48 48 TYR C C 48 175.700 175.700 176.008 -0.308 18755
2773 1 5 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.583 1.383 18755
2774 1 5 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.643 3.924 18755
2775 1 5 . 1 1 48 48 TYR H H 48 8.614 8.614 8.177 0.437 18755
2776 1 5 . 1 1 49 49 THR N N 49 110.720 110.720 112.253 -1.533 18755
2777 1 5 . 1 1 49 49 THR HA H 49 5.318 5.318 4.842 0.476 18755
2778 1 5 . 1 1 49 49 THR C C 49 178.400 178.400 176.067 2.333 18755
2779 1 5 . 1 1 49 49 THR CA C 49 61.019 61.019 60.058 0.961 18755
2780 1 5 . 1 1 49 49 THR CB C 49 71.104 71.104 70.810 0.294 18755
2781 1 5 . 1 1 49 49 THR H H 49 8.761 8.761 8.594 0.168 18755
2782 1 5 . 1 1 50 50 MET N N 50 121.906 121.906 122.112 -0.206 18755
2783 1 5 . 1 1 50 50 MET HA H 50 4.196 4.196 3.896 0.300 18755
2784 1 5 . 1 1 50 50 MET C C 50 178.300 178.300 177.225 1.075 18755
2785 1 5 . 1 1 50 50 MET CA C 50 57.557 57.557 59.718 -2.161 18755
2786 1 5 . 1 1 50 50 MET CB C 50 30.037 30.037 32.517 -2.481 18755
2787 1 5 . 1 1 50 50 MET H H 50 7.901 7.901 9.069 -1.168 18755
2788 1 5 . 1 1 51 51 LYS N N 51 115.600 115.600 118.636 -3.036 18755
2789 1 5 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.051 0.234 18755
2790 1 5 . 1 1 51 51 LYS C C 51 179.100 179.100 178.674 0.426 18755
2791 1 5 . 1 1 51 51 LYS CA C 51 59.322 59.322 59.035 0.287 18755
2792 1 5 . 1 1 51 51 LYS CB C 51 32.140 32.140 32.151 -0.011 18755
2793 1 5 . 1 1 51 51 LYS H H 51 8.413 8.413 7.809 0.604 18755
2794 1 5 . 1 1 52 52 GLU N N 52 120.906 120.906 120.466 0.440 18755
2795 1 5 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.790 0.613 18755
2796 1 5 . 1 1 52 52 GLU C C 52 178.200 178.200 178.461 -0.261 18755
2797 1 5 . 1 1 52 52 GLU CA C 52 58.778 58.778 59.074 -0.296 18755
2798 1 5 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.418 2.372 18755
2799 1 5 . 1 1 52 52 GLU H H 52 7.646 7.646 7.941 -0.295 18755
2800 1 5 . 1 1 53 53 VAL N N 53 120.300 120.300 119.795 0.505 18755
2801 1 5 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.761 -0.580 18755
2802 1 5 . 1 1 53 53 VAL C C 53 177.500 177.500 177.850 -0.350 18755
2803 1 5 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.800 0.625 18755
2804 1 5 . 1 1 53 53 VAL CB C 53 30.360 30.360 30.984 -0.624 18755
2805 1 5 . 1 1 53 53 VAL H H 53 7.972 7.972 8.507 -0.535 18755
2806 1 5 . 1 1 54 54 LEU N N 54 120.594 120.594 117.543 3.051 18755
2807 1 5 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.112 -0.428 18755
2808 1 5 . 1 1 54 54 LEU C C 54 178.900 178.900 179.101 -0.201 18755
2809 1 5 . 1 1 54 54 LEU CA C 54 55.110 55.110 57.095 -1.985 18755
2810 1 5 . 1 1 54 54 LEU CB C 54 39.237 39.237 40.017 -0.780 18755
2811 1 5 . 1 1 54 54 LEU H H 54 8.063 8.063 7.854 0.209 18755
2812 1 5 . 1 1 55 55 PHE N N 55 120.300 120.300 119.682 0.618 18755
2813 1 5 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.168 -0.216 18755
2814 1 5 . 1 1 55 55 PHE C C 55 177.900 177.900 177.423 0.477 18755
2815 1 5 . 1 1 55 55 PHE CA C 55 61.017 61.017 61.750 -0.733 18755
2816 1 5 . 1 1 55 55 PHE CB C 55 38.083 38.083 39.103 -1.020 18755
2817 1 5 . 1 1 55 55 PHE H H 55 7.339 7.339 7.524 -0.185 18755
2818 1 5 . 1 1 56 56 TYR N N 56 119.500 119.500 117.369 2.131 18755
2819 1 5 . 1 1 56 56 TYR HA H 56 3.740 3.740 3.974 -0.234 18755
2820 1 5 . 1 1 56 56 TYR C C 56 178.200 178.200 178.287 -0.087 18755
2821 1 5 . 1 1 56 56 TYR CA C 56 62.737 62.737 61.107 1.630 18755
2822 1 5 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.484 1.385 18755
2823 1 5 . 1 1 56 56 TYR H H 56 8.074 8.074 7.325 0.749 18755
2824 1 5 . 1 1 57 57 LEU N N 57 119.895 119.895 119.462 0.433 18755
2825 1 5 . 1 1 57 57 LEU HA H 57 3.858 3.858 3.978 -0.120 18755
2826 1 5 . 1 1 57 57 LEU C C 57 178.800 178.800 179.672 -0.872 18755
2827 1 5 . 1 1 57 57 LEU CA C 57 57.567 57.567 57.901 -0.334 18755
2828 1 5 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.438 0.720 18755
2829 1 5 . 1 1 57 57 LEU H H 57 8.628 8.628 8.244 0.384 18755
2830 1 5 . 1 1 58 58 GLY N N 58 107.015 107.015 106.182 0.833 18755
2831 1 5 . 1 1 58 58 GLY C C 58 175.028 175.028 176.206 -1.178 18755
2832 1 5 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.945 0.158 18755
2833 1 5 . 1 1 58 58 GLY H H 58 8.245 8.245 8.355 -0.110 18755
2834 1 5 . 1 1 59 59 GLN N N 59 119.400 119.400 120.510 -1.110 18755
2835 1 5 . 1 1 59 59 GLN HA H 59 3.793 3.793 4.037 -0.244 18755
2836 1 5 . 1 1 59 59 GLN C C 59 178.900 178.900 177.437 1.463 18755
2837 1 5 . 1 1 59 59 GLN CA C 59 58.023 58.023 57.941 0.082 18755
2838 1 5 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.591 0.292 18755
2839 1 5 . 1 1 59 59 GLN H H 59 7.400 7.400 8.123 -0.723 18755
2840 1 5 . 1 1 60 60 TYR N N 60 123.589 123.589 122.550 1.039 18755
2841 1 5 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.081 -0.394 18755
2842 1 5 . 1 1 60 60 TYR C C 60 175.700 175.700 177.450 -1.750 18755
2843 1 5 . 1 1 60 60 TYR CA C 60 62.621 62.621 61.564 1.057 18755
2844 1 5 . 1 1 60 60 TYR CB C 60 38.069 38.069 38.165 -0.096 18755
2845 1 5 . 1 1 60 60 TYR H H 60 8.521 8.521 8.351 0.170 18755
2846 1 5 . 1 1 61 61 ILE N N 61 118.996 118.996 118.137 0.859 18755
2847 1 5 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.340 -0.215 18755
2848 1 5 . 1 1 61 61 ILE C C 61 177.600 177.600 177.425 0.175 18755
2849 1 5 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.534 0.374 18755
2850 1 5 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.523 0.570 18755
2851 1 5 . 1 1 61 61 ILE H H 61 8.240 8.240 7.626 0.614 18755
2852 1 5 . 1 1 62 62 MET N N 62 115.500 115.500 118.560 -3.060 18755
2853 1 5 . 1 1 62 62 MET HA H 62 4.333 4.333 4.061 0.272 18755
2854 1 5 . 1 1 62 62 MET C C 62 180.000 180.000 178.706 1.294 18755
2855 1 5 . 1 1 62 62 MET CA C 62 57.270 57.270 59.142 -1.872 18755
2856 1 5 . 1 1 62 62 MET CB C 62 30.961 30.961 32.626 -1.665 18755
2857 1 5 . 1 1 62 62 MET H H 62 7.750 7.750 7.499 0.251 18755
2858 1 5 . 1 1 63 63 THR N N 63 117.070 117.070 114.182 2.888 18755
2859 1 5 . 1 1 63 63 THR HA H 63 3.865 3.865 4.080 -0.215 18755
2860 1 5 . 1 1 63 63 THR C C 63 176.200 176.200 176.029 0.171 18755
2861 1 5 . 1 1 63 63 THR CA C 63 65.992 65.992 65.095 0.897 18755
2862 1 5 . 1 1 63 63 THR CB C 63 68.857 68.857 68.762 0.095 18755
2863 1 5 . 1 1 63 63 THR H H 63 8.423 8.423 8.239 0.184 18755
2864 1 5 . 1 1 64 64 LYS N N 64 118.512 118.512 118.663 -0.151 18755
2865 1 5 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.287 -0.333 18755
2866 1 5 . 1 1 64 64 LYS C C 64 174.500 174.500 175.739 -1.239 18755
2867 1 5 . 1 1 64 64 LYS CA C 64 55.027 55.027 54.651 0.376 18755
2868 1 5 . 1 1 64 64 LYS CB C 64 30.673 30.673 32.393 -1.720 18755
2869 1 5 . 1 1 64 64 LYS H H 64 7.678 7.678 7.911 -0.233 18755
2870 1 5 . 1 1 65 65 ARG N N 65 115.400 115.400 116.791 -1.391 18755
2871 1 5 . 1 1 65 65 ARG HA H 65 3.764 3.764 4.082 -0.318 18755
2872 1 5 . 1 1 65 65 ARG C C 65 175.900 175.900 176.702 -0.802 18755
2873 1 5 . 1 1 65 65 ARG CA C 65 56.475 56.475 57.029 -0.554 18755
2874 1 5 . 1 1 65 65 ARG CB C 65 25.911 25.911 26.954 -1.043 18755
2875 1 5 . 1 1 65 65 ARG H H 65 7.467 7.467 7.486 -0.019 18755
2876 1 5 . 1 1 66 66 LEU N N 66 115.591 115.591 116.902 -1.311 18755
2877 1 5 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.124 0.211 18755
2878 1 5 . 1 1 66 66 LEU C C 66 175.400 175.400 177.990 -2.590 18755
2879 1 5 . 1 1 66 66 LEU CA C 66 54.526 54.526 57.062 -2.536 18755
2880 1 5 . 1 1 66 66 LEU CB C 66 41.682 41.682 42.385 -0.703 18755
2881 1 5 . 1 1 66 66 LEU H H 66 7.612 7.612 7.557 0.055 18755
2882 1 5 . 1 1 67 67 TYR N N 67 116.298 116.298 115.786 0.512 18755
2883 1 5 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.340 0.411 18755
2884 1 5 . 1 1 67 67 TYR C C 67 173.576 173.576 175.731 -2.155 18755
2885 1 5 . 1 1 67 67 TYR CA C 67 55.334 55.334 56.217 -0.883 18755
2886 1 5 . 1 1 67 67 TYR CB C 67 40.410 40.410 37.116 3.294 18755
2887 1 5 . 1 1 67 67 TYR H H 67 7.127 7.127 7.451 -0.324 18755
2888 1 5 . 1 1 68 68 ASP N N 68 124.792 124.792 123.948 0.844 18755
2889 1 5 . 1 1 68 68 ASP C C 68 175.741 175.741 174.975 0.766 18755
2890 1 5 . 1 1 68 68 ASP CA C 68 53.209 53.209 53.918 -0.709 18755
2891 1 5 . 1 1 68 68 ASP CB C 68 42.503 42.503 41.979 0.524 18755
2892 1 5 . 1 1 68 68 ASP H H 68 8.205 8.205 8.779 -0.574 18755
2893 1 5 . 1 1 69 69 GLU N N 69 123.507 123.507 119.965 3.542 18755
2894 1 5 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.690 -0.893 18755
2895 1 5 . 1 1 69 69 GLU C C 69 176.859 176.859 176.388 0.471 18755
2896 1 5 . 1 1 69 69 GLU CA C 69 57.980 57.980 54.404 3.576 18755
2897 1 5 . 1 1 69 69 GLU CB C 69 29.260 29.260 29.897 -0.637 18755
2898 1 5 . 1 1 69 69 GLU H H 69 8.440 8.440 8.358 0.082 18755
2899 1 5 . 1 1 70 70 LYS N N 70 117.904 117.904 124.604 -6.700 18755
2900 1 5 . 1 1 70 70 LYS HA H 70 4.325 4.325 4.015 0.310 18755
2901 1 5 . 1 1 70 70 LYS C C 70 177.016 177.016 177.828 -0.812 18755
2902 1 5 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.825 -1.784 18755
2903 1 5 . 1 1 70 70 LYS CB C 70 32.090 32.090 32.068 0.022 18755
2904 1 5 . 1 1 70 70 LYS H H 70 8.208 8.208 8.813 -0.605 18755
2905 1 5 . 1 1 71 71 GLN N N 71 118.762 118.762 118.890 -0.128 18755
2906 1 5 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.067 0.258 18755
2907 1 5 . 1 1 71 71 GLN C C 71 175.300 175.300 176.427 -1.127 18755
2908 1 5 . 1 1 71 71 GLN CA C 71 54.920 54.920 57.393 -2.473 18755
2909 1 5 . 1 1 71 71 GLN CB C 71 28.850 28.850 28.867 -0.017 18755
2910 1 5 . 1 1 71 71 GLN H H 71 7.934 7.934 8.550 -0.616 18755
2911 1 5 . 1 1 72 72 GLN N N 72 118.200 118.200 118.597 -0.397 18755
2912 1 5 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.111 -0.076 18755
2913 1 5 . 1 1 72 72 GLN C C 72 175.022 175.022 175.411 -0.389 18755
2914 1 5 . 1 1 72 72 GLN CA C 72 57.210 57.210 56.008 1.202 18755
2915 1 5 . 1 1 72 72 GLN CB C 72 27.880 27.880 29.734 -1.854 18755
2916 1 5 . 1 1 72 72 GLN H H 72 8.051 8.051 7.977 0.074 18755
2917 1 5 . 1 1 74 74 ILE N N 74 120.607 120.607 121.191 -0.584 18755
2918 1 5 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.729 0.584 18755
2919 1 5 . 1 1 74 74 ILE C C 74 174.400 174.400 174.748 -0.348 18755
2920 1 5 . 1 1 74 74 ILE CA C 74 58.521 58.521 62.179 -3.658 18755
2921 1 5 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.089 -0.847 18755
2922 1 5 . 1 1 75 75 VAL N N 75 126.197 126.197 123.617 2.580 18755
2923 1 5 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.460 -0.700 18755
2924 1 5 . 1 1 75 75 VAL C C 75 174.100 174.100 173.372 0.728 18755
2925 1 5 . 1 1 75 75 VAL CA C 75 60.538 60.538 58.698 1.840 18755
2926 1 5 . 1 1 75 75 VAL CB C 75 31.759 31.759 34.659 -2.900 18755
2927 1 5 . 1 1 75 75 VAL H H 75 8.274 8.274 7.676 0.598 18755
2928 1 5 . 1 1 76 76 TYR N N 76 126.301 126.301 125.478 0.823 18755
2929 1 5 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.383 -0.814 18755
2930 1 5 . 1 1 76 76 TYR C C 76 175.000 175.000 176.516 -1.516 18755
2931 1 5 . 1 1 76 76 TYR CA C 76 57.648 57.648 56.560 1.088 18755
2932 1 5 . 1 1 76 76 TYR CB C 76 38.188 38.188 41.016 -2.828 18755
2933 1 5 . 1 1 76 76 TYR H H 76 8.110 8.110 8.012 0.098 18755
2934 1 5 . 1 1 77 77 CYS N N 77 117.781 117.781 119.564 -1.783 18755
2935 1 5 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.838 -0.056 18755
2936 1 5 . 1 1 77 77 CYS C C 77 173.429 173.429 174.608 -1.179 18755
2937 1 5 . 1 1 77 77 CYS CA C 77 55.361 55.361 58.522 -3.161 18755
2938 1 5 . 1 1 77 77 CYS CB C 77 29.255 29.255 29.398 -0.144 18755
2939 1 5 . 1 1 77 77 CYS H H 77 8.295 8.295 8.549 -0.254 18755
2940 1 5 . 1 1 78 78 SER N N 78 116.896 116.896 120.094 -3.198 18755
2941 1 5 . 1 1 78 78 SER HA H 78 4.182 4.182 4.591 -0.409 18755
2942 1 5 . 1 1 78 78 SER CA C 78 60.064 60.064 57.504 2.561 18755
2943 1 5 . 1 1 78 78 SER CB C 78 63.122 63.122 63.695 -0.573 18755
2944 1 5 . 1 1 78 78 SER H H 78 7.585 7.585 8.703 -1.118 18755
2945 1 5 . 1 1 79 79 ASN N N 79 118.100 118.100 120.377 -2.277 18755
2946 1 5 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.718 -0.087 18755
2947 1 5 . 1 1 79 79 ASN C C 79 172.700 172.700 173.903 -1.203 18755
2948 1 5 . 1 1 79 79 ASN CA C 79 52.850 52.850 53.542 -0.692 18755
2949 1 5 . 1 1 79 79 ASN CB C 79 37.796 37.796 38.149 -0.353 18755
2950 1 5 . 1 1 79 79 ASN H H 79 8.609 8.609 8.604 0.005 18755
2951 1 5 . 1 1 80 80 ASP N N 80 118.603 118.603 118.488 0.115 18755
2952 1 5 . 1 1 80 80 ASP HA H 80 4.774 4.774 4.945 -0.171 18755
2953 1 5 . 1 1 80 80 ASP C C 80 174.900 174.900 177.036 -2.136 18755
2954 1 5 . 1 1 80 80 ASP CA C 80 52.802 52.802 53.049 -0.247 18755
2955 1 5 . 1 1 80 80 ASP CB C 80 47.221 47.221 44.129 3.092 18755
2956 1 5 . 1 1 80 80 ASP H H 80 7.549 7.549 7.876 -0.327 18755
2957 1 5 . 1 1 81 81 LEU N N 81 129.094 129.094 119.946 9.148 18755
2958 1 5 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.454 -0.345 18755
2959 1 5 . 1 1 81 81 LEU C C 81 177.800 177.800 177.863 -0.063 18755
2960 1 5 . 1 1 81 81 LEU CA C 81 57.666 57.666 57.207 0.459 18755
2961 1 5 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.434 0.592 18755
2962 1 5 . 1 1 81 81 LEU H H 81 8.411 8.411 9.052 -0.641 18755
2963 1 5 . 1 1 82 82 LEU N N 82 118.601 118.601 122.042 -3.441 18755
2964 1 5 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.194 -0.730 18755
2965 1 5 . 1 1 82 82 LEU C C 82 178.100 178.100 178.755 -0.655 18755
2966 1 5 . 1 1 82 82 LEU CA C 82 57.811 57.811 56.938 0.873 18755
2967 1 5 . 1 1 82 82 LEU CB C 82 42.416 42.416 41.142 1.274 18755
2968 1 5 . 1 1 82 82 LEU H H 82 9.777 9.777 8.409 1.368 18755
2969 1 5 . 1 1 83 83 GLY N N 83 105.800 105.800 106.107 -0.307 18755
2970 1 5 . 1 1 83 83 GLY C C 83 176.900 176.900 175.748 1.152 18755
2971 1 5 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.549 1.005 18755
2972 1 5 . 1 1 83 83 GLY H H 83 7.592 7.592 7.896 -0.304 18755
2973 1 5 . 1 1 84 84 ASP N N 84 123.089 123.089 121.863 1.226 18755
2974 1 5 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.435 -0.153 18755
2975 1 5 . 1 1 84 84 ASP C C 84 178.600 178.600 177.663 0.937 18755
2976 1 5 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.765 -0.185 18755
2977 1 5 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.585 -0.690 18755
2978 1 5 . 1 1 84 84 ASP H H 84 7.366 7.366 8.467 -1.101 18755
2979 1 5 . 1 1 85 85 LEU N N 85 118.800 118.800 119.299 -0.499 18755
2980 1 5 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.804 0.183 18755
2981 1 5 . 1 1 85 85 LEU C C 85 178.900 178.900 178.025 0.875 18755
2982 1 5 . 1 1 85 85 LEU CA C 85 56.984 56.984 57.007 -0.023 18755
2983 1 5 . 1 1 85 85 LEU CB C 85 41.221 41.221 41.706 -0.485 18755
2984 1 5 . 1 1 85 85 LEU H H 85 7.981 7.981 7.390 0.591 18755
2985 1 5 . 1 1 86 86 PHE N N 86 117.812 117.812 114.528 3.284 18755
2986 1 5 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.318 0.084 18755
2987 1 5 . 1 1 86 86 PHE C C 86 176.400 176.400 177.558 -1.158 18755
2988 1 5 . 1 1 86 86 PHE CA C 86 55.833 55.833 59.242 -3.409 18755
2989 1 5 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.350 -2.022 18755
2990 1 5 . 1 1 86 86 PHE H H 86 8.531 8.531 7.360 1.171 18755
2991 1 5 . 1 1 87 87 GLY N N 87 107.899 107.899 107.844 0.055 18755
2992 1 5 . 1 1 87 87 GLY C C 87 173.800 173.800 174.218 -0.418 18755
2993 1 5 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.731 0.156 18755
2994 1 5 . 1 1 87 87 GLY H H 87 8.150 8.150 8.010 0.140 18755
2995 1 5 . 1 1 88 88 VAL N N 88 108.596 108.596 115.466 -6.870 18755
2996 1 5 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.802 0.095 18755
2997 1 5 . 1 1 88 88 VAL C C 88 174.100 174.100 174.640 -0.540 18755
2998 1 5 . 1 1 88 88 VAL CA C 88 56.703 56.703 58.111 -1.408 18755
2999 1 5 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.151 1.648 18755
3000 1 5 . 1 1 88 88 VAL H H 88 7.073 7.073 7.635 -0.562 18755
3001 1 5 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.696 -0.354 18755
3002 1 5 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.391 -1.511 18755
3003 1 5 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.401 -0.781 18755
3004 1 5 . 1 1 90 90 SER N N 90 110.799 110.799 113.927 -3.128 18755
3005 1 5 . 1 1 90 90 SER HA H 90 5.362 5.362 4.795 0.567 18755
3006 1 5 . 1 1 90 90 SER C C 90 172.300 172.300 173.404 -1.104 18755
3007 1 5 . 1 1 90 90 SER CA C 90 56.470 56.470 56.366 0.104 18755
3008 1 5 . 1 1 90 90 SER CB C 90 64.481 64.481 64.661 -0.180 18755
3009 1 5 . 1 1 90 90 SER H H 90 7.115 7.115 7.619 -0.504 18755
3010 1 5 . 1 1 91 91 PHE N N 91 112.909 112.909 121.782 -8.873 18755
3011 1 5 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.782 -0.021 18755
3012 1 5 . 1 1 91 91 PHE C C 91 171.600 171.600 174.635 -3.035 18755
3013 1 5 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.145 1.404 18755
3014 1 5 . 1 1 91 91 PHE CB C 91 39.765 39.765 40.083 -0.318 18755
3015 1 5 . 1 1 91 91 PHE H H 91 8.008 8.008 8.237 -0.229 18755
3016 1 5 . 1 1 92 92 SER N N 92 113.293 113.293 119.877 -6.584 18755
3017 1 5 . 1 1 92 92 SER HA H 92 5.184 5.184 4.402 0.782 18755
3018 1 5 . 1 1 92 92 SER C C 92 177.900 177.900 174.990 2.910 18755
3019 1 5 . 1 1 92 92 SER CA C 92 55.256 55.256 57.874 -2.618 18755
3020 1 5 . 1 1 92 92 SER CB C 92 63.592 63.592 62.414 1.177 18755
3021 1 5 . 1 1 92 92 SER H H 92 8.708 8.708 8.869 -0.161 18755
3022 1 5 . 1 1 93 93 VAL N N 93 121.309 121.309 124.549 -3.240 18755
3023 1 5 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.793 0.513 18755
3024 1 5 . 1 1 93 93 VAL C C 93 173.760 173.760 175.565 -1.805 18755
3025 1 5 . 1 1 93 93 VAL CA C 93 63.973 63.973 64.742 -0.769 18755
3026 1 5 . 1 1 93 93 VAL CB C 93 31.402 31.402 31.932 -0.530 18755
3027 1 5 . 1 1 93 93 VAL H H 93 8.879 8.879 7.674 1.205 18755
3028 1 5 . 1 1 94 94 LYS N N 94 113.118 113.118 112.269 0.849 18755
3029 1 5 . 1 1 94 94 LYS HA H 94 4.380 4.380 4.062 0.318 18755
3030 1 5 . 1 1 94 94 LYS C C 94 177.300 177.300 175.838 1.462 18755
3031 1 5 . 1 1 94 94 LYS CA C 94 55.036 55.036 56.489 -1.453 18755
3032 1 5 . 1 1 94 94 LYS CB C 94 32.231 32.231 31.857 0.374 18755
3033 1 5 . 1 1 94 94 LYS H H 94 7.836 7.836 8.052 -0.216 18755
3034 1 5 . 1 1 95 95 GLU N N 95 119.700 119.700 121.766 -2.066 18755
3035 1 5 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.508 -0.023 18755
3036 1 5 . 1 1 95 95 GLU C C 95 176.100 176.100 175.940 0.160 18755
3037 1 5 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.605 -0.019 18755
3038 1 5 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.921 0.021 18755
3039 1 5 . 1 1 95 95 GLU H H 95 6.901 6.901 7.774 -0.873 18755
3040 1 5 . 1 1 96 96 HIS N N 96 121.512 121.512 120.321 1.191 18755
3041 1 5 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.027 0.330 18755
3042 1 5 . 1 1 96 96 HIS C C 96 177.300 177.300 176.978 0.322 18755
3043 1 5 . 1 1 96 96 HIS CA C 96 58.495 58.495 60.921 -2.426 18755
3044 1 5 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.567 1.398 18755
3045 1 5 . 1 1 96 96 HIS H H 96 7.568 7.568 6.706 0.862 18755
3046 1 5 . 1 1 97 97 ARG N N 97 120.300 120.300 119.049 1.251 18755
3047 1 5 . 1 1 97 97 ARG HA H 97 3.888 3.888 3.952 -0.064 18755
3048 1 5 . 1 1 97 97 ARG C C 97 177.800 177.800 177.582 0.218 18755
3049 1 5 . 1 1 97 97 ARG CA C 97 57.432 57.432 59.401 -1.969 18755
3050 1 5 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.766 -3.916 18755
3051 1 5 . 1 1 98 98 LYS N N 98 120.600 120.600 119.620 0.980 18755
3052 1 5 . 1 1 98 98 LYS C C 98 178.500 178.500 179.252 -0.752 18755
3053 1 5 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.582 0.488 18755
3054 1 5 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.674 -0.854 18755
3055 1 5 . 1 1 98 98 LYS H H 98 7.741 7.741 7.960 -0.219 18755
3056 1 5 . 1 1 99 99 ILE N N 99 119.394 119.394 118.345 1.049 18755
3057 1 5 . 1 1 99 99 ILE HA H 99 3.017 3.017 4.076 -1.059 18755
3058 1 5 . 1 1 99 99 ILE C C 99 177.000 177.000 178.157 -1.157 18755
3059 1 5 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.314 0.550 18755
3060 1 5 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.774 -0.090 18755
3061 1 5 . 1 1 99 99 ILE H H 99 7.585 7.585 8.189 -0.604 18755
3062 1 5 . 1 1 100 100 TYR N N 100 121.894 121.894 120.162 1.732 18755
3063 1 5 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.196 -1.003 18755
3064 1 5 . 1 1 100 100 TYR C C 100 176.500 176.500 178.184 -1.684 18755
3065 1 5 . 1 1 100 100 TYR CA C 100 63.706 63.706 62.826 0.880 18755
3066 1 5 . 1 1 100 100 TYR CB C 100 37.142 37.142 38.523 -1.381 18755
3067 1 5 . 1 1 100 100 TYR H H 100 8.430 8.430 8.938 -0.508 18755
3068 1 5 . 1 1 101 101 THR N N 101 113.693 113.693 114.682 -0.989 18755
3069 1 5 . 1 1 101 101 THR HA H 101 3.805 3.805 4.168 -0.363 18755
3070 1 5 . 1 1 101 101 THR C C 101 176.100 176.100 176.113 -0.013 18755
3071 1 5 . 1 1 101 101 THR CA C 101 67.003 67.003 66.971 0.032 18755
3072 1 5 . 1 1 101 101 THR CB C 101 68.496 68.496 68.704 -0.208 18755
3073 1 5 . 1 1 101 101 THR H H 101 8.232 8.232 7.892 0.340 18755
3074 1 5 . 1 1 102 102 MET N N 102 119.500 119.500 118.865 0.635 18755
3075 1 5 . 1 1 102 102 MET C C 102 178.000 178.000 179.146 -1.146 18755
3076 1 5 . 1 1 102 102 MET CA C 102 59.360 59.360 57.724 1.636 18755
3077 1 5 . 1 1 102 102 MET CB C 102 31.110 31.110 31.900 -0.790 18755
3078 1 5 . 1 1 102 102 MET H H 102 7.461 7.461 7.769 -0.308 18755
3079 1 5 . 1 1 103 103 ILE N N 103 120.103 120.103 120.053 0.050 18755
3080 1 5 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.488 -0.325 18755
3081 1 5 . 1 1 103 103 ILE C C 103 178.700 178.700 178.193 0.507 18755
3082 1 5 . 1 1 103 103 ILE CA C 103 66.114 66.114 64.924 1.190 18755
3083 1 5 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.462 -0.078 18755
3084 1 5 . 1 1 103 103 ILE H H 103 7.824 7.824 8.065 -0.241 18755
3085 1 5 . 1 1 104 104 TYR N N 104 119.500 119.500 119.744 -0.244 18755
3086 1 5 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.190 -0.124 18755
3087 1 5 . 1 1 104 104 TYR C C 104 177.300 177.300 176.023 1.277 18755
3088 1 5 . 1 1 104 104 TYR CA C 104 60.505 60.505 60.624 -0.119 18755
3089 1 5 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.354 -0.711 18755
3090 1 5 . 1 1 104 104 TYR H H 104 8.694 8.694 8.608 0.086 18755
3091 1 5 . 1 1 105 105 ARG N N 105 114.400 114.400 117.985 -3.585 18755
3092 1 5 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.036 0.201 18755
3093 1 5 . 1 1 105 105 ARG C C 105 176.500 176.500 175.732 0.768 18755
3094 1 5 . 1 1 105 105 ARG CA C 105 58.128 58.128 56.447 1.681 18755
3095 1 5 . 1 1 105 105 ARG CB C 105 30.266 30.266 31.004 -0.738 18755
3096 1 5 . 1 1 105 105 ARG H H 105 6.713 6.713 7.386 -0.673 18755
3097 1 5 . 1 1 106 106 ASN N N 106 116.011 116.011 117.868 -1.857 18755
3098 1 5 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.793 0.041 18755
3099 1 5 . 1 1 106 106 ASN C C 106 171.800 171.800 173.018 -1.218 18755
3100 1 5 . 1 1 106 106 ASN CA C 106 53.484 53.484 53.022 0.462 18755
3101 1 5 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.625 1.321 18755
3102 1 5 . 1 1 106 106 ASN H H 106 8.396 8.396 7.912 0.484 18755
3103 1 5 . 1 1 107 107 LEU N N 107 115.594 115.594 115.467 0.127 18755
3104 1 5 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.725 0.054 18755
3105 1 5 . 1 1 107 107 LEU C C 107 173.500 173.500 174.976 -1.476 18755
3106 1 5 . 1 1 107 107 LEU CA C 107 54.230 54.230 53.039 1.191 18755
3107 1 5 . 1 1 107 107 LEU CB C 107 45.490 45.490 44.178 1.312 18755
3108 1 5 . 1 1 107 107 LEU H H 107 7.551 7.551 7.225 0.326 18755
3109 1 5 . 1 1 108 108 VAL N N 108 117.493 117.493 122.798 -5.305 18755
3110 1 5 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.304 0.010 18755
3111 1 5 . 1 1 108 108 VAL C C 108 175.100 175.100 175.142 -0.042 18755
3112 1 5 . 1 1 108 108 VAL CA C 108 60.620 60.620 60.862 -0.242 18755
3113 1 5 . 1 1 108 108 VAL CB C 108 34.322 34.322 30.832 3.490 18755
3114 1 5 . 1 1 108 108 VAL H H 108 7.906 7.906 8.613 -0.707 18755
3115 1 5 . 1 1 109 109 VAL N N 109 128.100 128.100 122.947 5.153 18755
3116 1 5 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.286 -0.307 18755
3117 1 5 . 1 1 109 109 VAL C C 109 176.000 176.000 175.394 0.606 18755
3118 1 5 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.787 0.532 18755
3119 1 5 . 1 1 109 109 VAL CB C 109 31.909 31.909 32.081 -0.172 18755
3120 1 5 . 1 1 109 109 VAL H H 109 8.740 8.740 8.409 0.331 18755
3121 1 5 . 1 1 110 110 VAL N N 110 127.704 127.704 123.342 4.362 18755
3122 1 5 . 1 1 110 110 VAL HA H 110 3.785 3.785 4.240 -0.455 18755
3123 1 5 . 1 1 110 110 VAL C C 110 175.300 175.300 176.383 -1.083 18755
3124 1 5 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.597 -0.707 18755
3125 1 5 . 1 1 110 110 VAL H H 110 8.283 8.283 8.812 -0.529 18755
3126 1 5 . 1 1 111 111 ASN N N 111 122.500 122.500 118.680 3.820 18755
3127 1 5 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.963 -0.337 18755
3128 1 5 . 1 1 111 111 ASN C C 111 174.728 174.728 173.764 0.964 18755
3129 1 5 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.626 0.192 18755
3130 1 5 . 1 1 111 111 ASN CB C 111 38.664 38.664 40.468 -1.804 18755
3131 1 5 . 1 1 111 111 ASN H H 111 8.488 8.488 8.253 0.235 18755
3132 1 5 . 1 1 112 112 GLN N N 112 121.700 121.700 120.071 1.629 18755
3133 1 5 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.757 -0.563 18755
3134 1 5 . 1 1 112 112 GLN C C 112 175.600 175.600 175.542 0.058 18755
3135 1 5 . 1 1 112 112 GLN CA C 112 55.958 55.958 54.906 1.052 18755
3136 1 5 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.508 -1.533 18755
3137 1 5 . 1 1 112 112 GLN H H 112 8.366 8.366 8.394 -0.028 18755
3138 1 5 . 1 1 113 113 GLN N N 113 122.200 122.200 119.162 3.038 18755
3139 1 5 . 1 1 113 113 GLN C C 113 176.200 176.200 174.803 1.397 18755
3140 1 5 . 1 1 113 113 GLN CA C 113 56.500 56.500 55.670 0.830 18755
3141 1 5 . 1 1 113 113 GLN CB C 113 30.030 30.030 29.187 0.843 18755
3142 1 5 . 1 1 113 113 GLN H H 113 8.331 8.331 8.566 -0.235 18755
3143 1 5 . 1 1 115 115 SER N N 115 116.889 116.889 114.833 2.056 18755
3144 1 5 . 1 1 115 115 SER HA H 115 4.392 4.392 4.796 -0.404 18755
3145 1 5 . 1 1 115 115 SER C C 115 174.412 174.412 173.871 0.541 18755
3146 1 5 . 1 1 115 115 SER CA C 115 57.837 57.837 57.564 0.273 18755
3147 1 5 . 1 1 115 115 SER CB C 115 63.574 63.574 64.059 -0.485 18755
3148 1 5 . 1 1 115 115 SER H H 115 8.302 8.302 7.739 0.563 18755
3149 1 5 . 1 1 116 116 SER N N 116 118.000 118.000 116.331 1.669 18755
3150 1 5 . 1 1 116 116 SER HA H 116 4.381 4.381 4.458 -0.077 18755
3151 1 5 . 1 1 116 116 SER C C 116 174.100 174.100 173.991 0.109 18755
3152 1 5 . 1 1 116 116 SER CA C 116 58.062 58.062 58.022 0.040 18755
3153 1 5 . 1 1 116 116 SER CB C 116 63.460 63.460 63.764 -0.304 18755
3154 1 5 . 1 1 116 116 SER H H 116 8.350 8.350 8.269 0.081 18755
3155 1 5 . 1 1 117 117 ASP N N 117 122.400 122.400 121.784 0.616 18755
3156 1 5 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.874 -0.323 18755
3157 1 5 . 1 1 117 117 ASP C C 117 176.200 176.200 175.570 0.630 18755
3158 1 5 . 1 1 117 117 ASP CA C 117 54.140 54.140 53.383 0.757 18755
3159 1 5 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.937 -0.957 18755
3160 1 5 . 1 1 117 117 ASP H H 117 8.274 8.274 8.572 -0.298 18755
3161 1 5 . 1 1 118 118 SER N N 118 116.593 116.593 114.688 1.905 18755
3162 1 5 . 1 1 118 118 SER HA H 118 4.296 4.296 4.779 -0.483 18755
3163 1 5 . 1 1 118 118 SER C C 118 175.000 175.000 174.128 0.872 18755
3164 1 5 . 1 1 118 118 SER CA C 118 58.660 58.660 58.190 0.470 18755
3165 1 5 . 1 1 118 118 SER CB C 118 63.550 63.550 64.712 -1.162 18755
3166 1 5 . 1 1 118 118 SER H H 118 8.210 8.210 8.724 -0.514 18755
3167 1 5 . 1 1 119 119 GLY N N 119 110.896 110.896 111.374 -0.478 18755
3168 1 5 . 1 1 119 119 GLY C C 119 174.100 174.100 172.807 1.293 18755
3169 1 5 . 1 1 119 119 GLY CA C 119 45.180 45.180 44.420 0.760 18755
3170 1 5 . 1 1 119 119 GLY H H 119 8.376 8.376 8.210 0.166 18755
3171 1 5 . 1 1 120 120 THR N N 120 113.503 113.503 115.379 -1.876 18755
3172 1 5 . 1 1 120 120 THR HA H 120 4.255 4.255 4.840 -0.585 18755
3173 1 5 . 1 1 120 120 THR C C 120 174.385 174.385 174.957 -0.572 18755
3174 1 5 . 1 1 120 120 THR CA C 120 61.490 61.490 61.615 -0.125 18755
3175 1 5 . 1 1 120 120 THR CB C 120 69.690 69.690 70.981 -1.291 18755
3176 1 5 . 1 1 120 120 THR H H 120 7.932 7.932 8.754 -0.822 18755
3177 1 5 . 1 1 121 121 SER N N 121 118.800 118.800 117.796 1.004 18755
3178 1 5 . 1 1 121 121 SER HA H 121 4.354 4.354 4.806 -0.452 18755
3179 1 5 . 1 1 121 121 SER C C 121 174.120 174.120 173.416 0.704 18755
3180 1 5 . 1 1 121 121 SER CA C 121 57.876 57.876 57.460 0.416 18755
3181 1 5 . 1 1 121 121 SER CB C 121 63.650 63.650 64.108 -0.458 18755
3182 1 5 . 1 1 121 121 SER H H 121 8.284 8.284 8.286 -0.002 18755
3183 1 5 . 1 1 122 122 VAL N N 122 121.801 121.801 120.642 1.159 18755
3184 1 5 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.378 -0.308 18755
3185 1 5 . 1 1 122 122 VAL C C 122 175.900 175.900 175.260 0.640 18755
3186 1 5 . 1 1 122 122 VAL CA C 122 61.859 61.859 62.272 -0.413 18755
3187 1 5 . 1 1 122 122 VAL CB C 122 32.315 32.315 32.952 -0.637 18755
3188 1 5 . 1 1 122 122 VAL H H 122 8.131 8.131 8.147 -0.016 18755
3189 1 5 . 1 1 123 123 SER N N 123 119.593 119.593 122.197 -2.604 18755
3190 1 5 . 1 1 123 123 SER HA H 123 4.331 4.331 4.627 -0.296 18755
3191 1 5 . 1 1 123 123 SER C C 123 174.000 174.000 173.800 0.200 18755
3192 1 5 . 1 1 123 123 SER CA C 123 57.780 57.780 58.668 -0.888 18755
3193 1 5 . 1 1 123 123 SER CB C 123 63.720 63.720 63.467 0.253 18755
3194 1 5 . 1 1 123 123 SER H H 123 8.277 8.277 8.531 -0.254 18755
3195 1 5 . 1 1 124 124 GLU N N 124 123.501 123.501 123.125 0.376 18755
3196 1 5 . 1 1 124 124 GLU HA H 124 4.186 4.186 4.534 -0.348 18755
3197 1 5 . 1 1 124 124 GLU C C 124 175.060 175.060 176.124 -1.064 18755
3198 1 5 . 1 1 124 124 GLU CA C 124 56.200 56.200 55.924 0.276 18755
3199 1 5 . 1 1 124 124 GLU CB C 124 30.270 30.270 30.412 -0.142 18755
3200 1 5 . 1 1 124 124 GLU H H 124 8.378 8.378 8.489 -0.111 18755
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 112 3.200 0.011 3.214 18755
2 1 1 "Average Difference" HA 110 0.408 0.111 0.394 18755
3 1 1 "Average Difference" C 106 1.370 -0.070 1.375 18755
4 1 1 "Average Difference" CA 109 1.907 0.183 1.907 18755
5 1 1 "Average Difference" CB 103 1.714 0.219 1.709 18755
6 1 1 "Average Difference" HN 110 0.581 0.062 0.580 18755
7 1 2 "Average Difference" N 112 3.214 -0.396 3.203 18755
8 1 2 "Average Difference" HA 110 0.411 0.131 0.391 18755
9 1 2 "Average Difference" C 106 1.398 -0.103 1.400 18755
10 1 2 "Average Difference" CA 109 2.049 0.219 2.047 18755
11 1 2 "Average Difference" CB 103 2.077 0.313 2.063 18755
12 1 2 "Average Difference" HN 110 0.570 0.079 0.567 18755
13 1 3 "Average Difference" N 112 3.133 -0.205 3.140 18755
14 1 3 "Average Difference" HA 110 0.428 0.111 0.415 18755
15 1 3 "Average Difference" C 106 1.344 -0.028 1.350 18755
16 1 3 "Average Difference" CA 109 1.922 0.237 1.916 18755
17 1 3 "Average Difference" CB 103 1.888 0.244 1.881 18755
18 1 3 "Average Difference" HN 110 0.562 0.069 0.560 18755
19 1 4 "Average Difference" N 112 2.972 -0.155 2.981 18755
20 1 4 "Average Difference" HA 110 0.424 0.106 0.412 18755
21 1 4 "Average Difference" C 106 1.390 -0.011 1.397 18755
22 1 4 "Average Difference" CA 109 1.928 0.182 1.928 18755
23 1 4 "Average Difference" CB 103 1.902 0.249 1.895 18755
24 1 4 "Average Difference" HN 110 0.552 0.101 0.545 18755
25 1 5 "Average Difference" N 112 3.037 -0.057 3.051 18755
26 1 5 "Average Difference" HA 110 0.448 0.112 0.436 18755
27 1 5 "Average Difference" C 106 1.300 -0.047 1.305 18755
28 1 5 "Average Difference" CA 109 1.812 0.275 1.799 18755
29 1 5 "Average Difference" CB 103 1.921 0.197 1.920 18755
30 1 5 "Average Difference" HN 110 0.559 0.119 0.548 18755
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 18755
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 CYS N N 2 123.192 123.192 119.558 3.634 18755
2 1 . 1 1 2 2 CYS H H 2 8.252 8.252 8.664 -0.412 18755
3 1 . 1 1 3 3 ASN N N 3 123.749 123.749 120.438 3.311 18755
4 1 . 1 1 3 3 ASN H H 3 8.128 8.128 8.529 -0.401 18755
5 1 . 1 1 6 6 MET N N 6 119.009 119.009 119.947 -0.938 18755
6 1 . 1 1 6 6 MET CA C 6 43.265 43.265 54.735 -11.470 18755
7 1 . 1 1 6 6 MET CB C 6 27.431 27.431 34.428 -6.997 18755
8 1 . 1 1 6 6 MET H H 6 7.099 7.099 8.268 -1.168 18755
9 1 . 1 1 7 7 SER N N 7 119.000 119.000 116.621 2.379 18755
10 1 . 1 1 7 7 SER HA H 7 4.337 4.337 4.549 -0.212 18755
11 1 . 1 1 7 7 SER C C 7 177.600 177.600 173.875 3.725 18755
12 1 . 1 1 7 7 SER CA C 7 57.850 57.850 58.490 -0.640 18755
13 1 . 1 1 7 7 SER CB C 7 63.720 63.720 63.973 -0.253 18755
14 1 . 1 1 7 7 SER H H 7 8.246 8.246 8.259 -0.013 18755
15 1 . 1 1 8 8 VAL N N 8 126.800 126.800 120.500 6.300 18755
16 1 . 1 1 8 8 VAL HA H 8 4.290 4.290 4.219 0.071 18755
17 1 . 1 1 8 8 VAL C C 8 180.600 180.600 174.191 6.409 18755
18 1 . 1 1 8 8 VAL CA C 8 55.790 55.790 61.043 -5.253 18755
19 1 . 1 1 8 8 VAL CB C 8 41.860 41.860 31.907 9.953 18755
20 1 . 1 1 8 8 VAL H H 8 7.988 7.988 8.213 -0.225 18755
21 1 . 1 1 9 9 PRO HA H 9 4.351 4.351 4.752 -0.401 18755
22 1 . 1 1 9 9 PRO C C 9 176.757 176.757 176.659 0.098 18755
23 1 . 1 1 10 10 THR N N 10 113.463 113.463 112.868 0.595 18755
24 1 . 1 1 10 10 THR HA H 10 4.235 4.235 4.446 -0.211 18755
25 1 . 1 1 10 10 THR C C 10 174.000 174.000 174.952 -0.952 18755
26 1 . 1 1 10 10 THR CA C 10 61.265 61.265 63.832 -2.567 18755
27 1 . 1 1 10 10 THR CB C 10 69.466 69.466 69.357 0.109 18755
28 1 . 1 1 10 10 THR H H 10 8.109 8.109 8.408 -0.299 18755
29 1 . 1 1 11 11 ASP N N 11 122.009 122.009 120.736 1.273 18755
30 1 . 1 1 11 11 ASP HA H 11 4.423 4.423 4.670 -0.247 18755
31 1 . 1 1 11 11 ASP C C 11 175.900 175.900 176.814 -0.914 18755
32 1 . 1 1 11 11 ASP CA C 11 54.245 54.245 53.986 0.259 18755
33 1 . 1 1 11 11 ASP CB C 11 40.957 40.957 41.355 -0.398 18755
34 1 . 1 1 11 11 ASP H H 11 8.180 8.180 8.341 -0.161 18755
35 1 . 1 1 12 12 GLY N N 12 108.549 108.549 108.299 0.250 18755
36 1 . 1 1 12 12 GLY C C 12 171.700 171.700 172.398 -0.698 18755
37 1 . 1 1 12 12 GLY CA C 12 44.481 44.481 45.070 -0.589 18755
38 1 . 1 1 12 12 GLY H H 12 7.409 7.409 7.987 -0.578 18755
39 1 . 1 1 13 13 ALA N N 13 119.600 119.600 121.121 -1.521 18755
40 1 . 1 1 13 13 ALA HA H 13 4.302 4.302 3.543 0.759 18755
41 1 . 1 1 13 13 ALA C C 13 176.400 176.400 174.197 2.203 18755
42 1 . 1 1 13 13 ALA CA C 13 51.676 51.676 50.747 0.929 18755
43 1 . 1 1 13 13 ALA CB C 13 20.646 20.646 20.361 0.285 18755
44 1 . 1 1 13 13 ALA H H 13 7.288 7.288 6.762 0.526 18755
45 1 . 1 1 14 14 VAL N N 14 118.098 118.098 118.199 -0.101 18755
46 1 . 1 1 14 14 VAL HA H 14 4.548 4.548 4.365 0.183 18755
47 1 . 1 1 14 14 VAL C C 14 174.300 174.300 175.111 -0.811 18755
48 1 . 1 1 14 14 VAL CA C 14 60.637 60.637 60.786 -0.149 18755
49 1 . 1 1 14 14 VAL CB C 14 34.173 34.173 33.474 0.699 18755
50 1 . 1 1 14 14 VAL H H 14 8.091 8.091 8.485 -0.394 18755
51 1 . 1 1 15 15 THR N N 15 116.900 116.900 115.522 1.378 18755
52 1 . 1 1 15 15 THR HA H 15 4.750 4.750 4.595 0.155 18755
53 1 . 1 1 15 15 THR C C 15 173.364 173.364 173.267 0.097 18755
54 1 . 1 1 15 15 THR CA C 15 60.011 60.011 61.436 -1.425 18755
55 1 . 1 1 15 15 THR CB C 15 71.125 71.125 71.074 0.050 18755
56 1 . 1 1 15 15 THR H H 15 8.303 8.303 8.343 -0.040 18755
57 1 . 1 1 16 16 THR N N 16 116.004 116.004 116.982 -0.978 18755
58 1 . 1 1 16 16 THR HA H 16 4.678 4.678 4.162 0.516 18755
59 1 . 1 1 16 16 THR C C 16 173.665 173.665 173.518 0.147 18755
60 1 . 1 1 16 16 THR CA C 16 57.028 57.028 60.766 -3.738 18755
61 1 . 1 1 16 16 THR CB C 16 67.263 67.263 71.383 -4.120 18755
62 1 . 1 1 16 16 THR H H 16 8.352 8.352 8.142 0.211 18755
63 1 . 1 1 17 17 SER N N 17 121.926 121.926 115.998 5.928 18755
64 1 . 1 1 17 17 SER HA H 17 4.440 4.440 4.690 -0.250 18755
65 1 . 1 1 17 17 SER CA C 17 58.639 58.639 59.409 -0.770 18755
66 1 . 1 1 17 17 SER CB C 17 63.087 63.087 64.527 -1.440 18755
67 1 . 1 1 17 17 SER H H 17 8.566 8.566 8.904 -0.338 18755
68 1 . 1 1 18 18 GLN N N 18 121.238 121.238 119.365 1.873 18755
69 1 . 1 1 18 18 GLN HA H 18 3.948 3.948 4.385 -0.437 18755
70 1 . 1 1 18 18 GLN C C 18 174.237 174.237 174.819 -0.582 18755
71 1 . 1 1 18 18 GLN CA C 18 57.485 57.485 57.366 0.119 18755
72 1 . 1 1 18 18 GLN CB C 18 29.687 29.687 30.196 -0.509 18755
73 1 . 1 1 18 18 GLN H H 18 9.115 9.115 8.606 0.509 18755
74 1 . 1 1 19 19 ILE N N 19 117.894 117.894 115.050 2.844 18755
75 1 . 1 1 19 19 ILE HA H 19 4.330 4.330 4.402 -0.072 18755
76 1 . 1 1 19 19 ILE C C 19 173.200 173.200 172.904 0.296 18755
77 1 . 1 1 19 19 ILE CA C 19 54.716 54.716 58.763 -4.047 18755
78 1 . 1 1 19 19 ILE CB C 19 40.058 40.058 38.336 1.722 18755
79 1 . 1 1 19 19 ILE H H 19 6.487 6.487 7.930 -1.443 18755
80 1 . 1 1 21 21 ALA N N 21 128.900 128.900 121.554 7.346 18755
81 1 . 1 1 21 21 ALA HA H 21 3.890 3.890 3.956 -0.066 18755
82 1 . 1 1 21 21 ALA C C 21 180.600 180.600 179.408 1.192 18755
83 1 . 1 1 21 21 ALA CA C 21 55.908 55.908 55.371 0.537 18755
84 1 . 1 1 21 21 ALA CB C 21 17.767 17.767 18.220 -0.453 18755
85 1 . 1 1 21 21 ALA H H 21 8.867 8.867 8.613 0.254 18755
86 1 . 1 1 22 22 SER N N 22 111.315 111.315 111.999 -0.684 18755
87 1 . 1 1 22 22 SER HA H 22 3.787 3.787 4.164 -0.377 18755
88 1 . 1 1 22 22 SER C C 22 178.400 178.400 175.574 2.826 18755
89 1 . 1 1 22 22 SER CA C 22 61.138 61.138 60.853 0.285 18755
90 1 . 1 1 22 22 SER CB C 22 60.854 60.854 62.598 -1.744 18755
91 1 . 1 1 22 22 SER H H 22 8.752 8.752 8.356 0.396 18755
92 1 . 1 1 23 23 GLU N N 23 122.700 122.700 118.183 4.517 18755
93 1 . 1 1 23 23 GLU HA H 23 4.008 4.008 4.397 -0.389 18755
94 1 . 1 1 23 23 GLU C C 23 179.100 179.100 176.977 2.123 18755
95 1 . 1 1 23 23 GLU CA C 23 58.515 58.515 56.949 1.566 18755
96 1 . 1 1 23 23 GLU CB C 23 29.358 29.358 30.453 -1.095 18755
97 1 . 1 1 23 23 GLU H H 23 6.949 6.949 7.687 -0.738 18755
98 1 . 1 1 24 24 GLN N N 24 118.007 118.007 116.412 1.595 18755
99 1 . 1 1 24 24 GLN HA H 24 4.473 4.473 4.531 -0.058 18755
100 1 . 1 1 24 24 GLN C C 24 175.200 175.200 175.909 -0.709 18755
101 1 . 1 1 24 24 GLN CA C 24 57.851 57.851 54.560 3.291 18755
102 1 . 1 1 24 24 GLN CB C 24 29.025 29.025 29.134 -0.109 18755
103 1 . 1 1 24 24 GLN H H 24 7.419 7.419 7.955 -0.536 18755
104 1 . 1 1 25 25 GLU N N 25 114.406 114.406 122.189 -7.783 18755
105 1 . 1 1 25 25 GLU HA H 25 4.296 4.296 4.279 0.017 18755
106 1 . 1 1 25 25 GLU C C 25 175.500 175.500 175.471 0.029 18755
107 1 . 1 1 25 25 GLU CA C 25 54.850 54.850 55.657 -0.807 18755
108 1 . 1 1 25 25 GLU CB C 25 29.660 29.660 28.034 1.626 18755
109 1 . 1 1 25 25 GLU H H 25 7.148 7.148 8.270 -1.122 18755
110 1 . 1 1 26 26 THR N N 26 116.297 116.297 117.746 -1.449 18755
111 1 . 1 1 26 26 THR HA H 26 3.808 3.808 4.575 -0.767 18755
112 1 . 1 1 26 26 THR C C 26 172.700 172.700 173.270 -0.570 18755
113 1 . 1 1 26 26 THR CA C 26 64.750 64.750 61.576 3.174 18755
114 1 . 1 1 26 26 THR CB C 26 69.899 69.899 70.446 -0.547 18755
115 1 . 1 1 26 26 THR H H 26 7.178 7.178 8.119 -0.941 18755
116 1 . 1 1 27 27 LEU N N 27 128.394 128.394 129.971 -1.577 18755
117 1 . 1 1 27 27 LEU HA H 27 4.774 4.774 4.337 0.437 18755
118 1 . 1 1 27 27 LEU C C 27 176.600 176.600 175.173 1.427 18755
119 1 . 1 1 27 27 LEU CA C 27 54.566 54.566 55.806 -1.240 18755
120 1 . 1 1 27 27 LEU CB C 27 42.977 42.977 43.265 -0.288 18755
121 1 . 1 1 27 27 LEU H H 27 8.381 8.381 8.901 -0.520 18755
122 1 . 1 1 28 28 VAL N N 28 117.407 117.407 121.772 -4.365 18755
123 1 . 1 1 28 28 VAL HA H 28 5.108 5.108 5.406 -0.298 18755
124 1 . 1 1 28 28 VAL C C 28 173.600 173.600 174.572 -0.972 18755
125 1 . 1 1 28 28 VAL CA C 28 58.968 58.968 58.729 0.239 18755
126 1 . 1 1 28 28 VAL CB C 28 36.828 36.828 35.290 1.538 18755
127 1 . 1 1 28 28 VAL H H 28 9.682 9.682 8.991 0.691 18755
128 1 . 1 1 29 29 ARG N N 29 121.300 121.300 124.929 -3.629 18755
129 1 . 1 1 29 29 ARG HA H 29 5.236 5.236 4.729 0.507 18755
130 1 . 1 1 29 29 ARG C C 29 174.700 174.700 174.034 0.666 18755
131 1 . 1 1 29 29 ARG CA C 29 52.103 52.103 52.836 -0.733 18755
132 1 . 1 1 29 29 ARG CB C 29 32.119 32.119 31.311 0.808 18755
133 1 . 1 1 29 29 ARG H H 29 9.164 9.164 8.106 1.058 18755
134 1 . 1 1 33 33 LEU N N 33 118.497 118.497 120.248 -1.751 18755
135 1 . 1 1 33 33 LEU HA H 33 4.063 4.063 4.235 -0.172 18755
136 1 . 1 1 33 33 LEU C C 33 178.140 178.140 178.492 -0.352 18755
137 1 . 1 1 33 33 LEU CA C 33 57.855 57.855 56.804 1.051 18755
138 1 . 1 1 33 33 LEU CB C 33 41.146 41.146 41.866 -0.720 18755
139 1 . 1 1 33 33 LEU H H 33 8.807 8.807 8.420 0.387 18755
140 1 . 1 1 34 34 LEU N N 34 118.106 118.106 120.762 -2.656 18755
141 1 . 1 1 34 34 LEU HA H 34 3.927 3.927 3.938 -0.011 18755
142 1 . 1 1 34 34 LEU C C 34 177.700 177.700 178.723 -1.023 18755
143 1 . 1 1 34 34 LEU CA C 34 56.526 56.526 57.971 -1.445 18755
144 1 . 1 1 34 34 LEU CB C 34 40.401 40.401 41.227 -0.825 18755
145 1 . 1 1 34 34 LEU H H 34 7.298 7.298 7.689 -0.391 18755
146 1 . 1 1 35 35 LEU N N 35 119.900 119.900 113.006 6.894 18755
147 1 . 1 1 35 35 LEU HA H 35 3.682 3.682 4.180 -0.498 18755
148 1 . 1 1 35 35 LEU C C 35 177.500 177.500 178.804 -1.304 18755
149 1 . 1 1 35 35 LEU CA C 35 57.820 57.820 56.837 0.983 18755
150 1 . 1 1 35 35 LEU CB C 35 41.257 41.257 40.259 0.998 18755
151 1 . 1 1 35 35 LEU H H 35 8.521 8.521 8.250 0.271 18755
152 1 . 1 1 36 36 LYS N N 36 118.000 118.000 119.733 -1.733 18755
153 1 . 1 1 36 36 LYS HA H 36 3.727 3.727 4.100 -0.373 18755
154 1 . 1 1 36 36 LYS C C 36 179.100 179.100 178.492 0.608 18755
155 1 . 1 1 36 36 LYS CA C 36 59.338 59.338 58.941 0.397 18755
156 1 . 1 1 36 36 LYS CB C 36 31.912 31.912 32.829 -0.917 18755
157 1 . 1 1 36 36 LYS H H 36 7.824 7.824 8.256 -0.432 18755
158 1 . 1 1 37 37 LEU N N 37 120.701 120.701 120.546 0.155 18755
159 1 . 1 1 37 37 LEU HA H 37 3.668 3.668 4.048 -0.380 18755
160 1 . 1 1 37 37 LEU C C 37 180.200 180.200 178.582 1.618 18755
161 1 . 1 1 37 37 LEU CA C 37 59.088 59.088 58.091 0.997 18755
162 1 . 1 1 37 37 LEU CB C 37 40.927 40.927 41.737 -0.810 18755
163 1 . 1 1 37 37 LEU H H 37 7.230 7.230 7.512 -0.282 18755
164 1 . 1 1 38 38 LEU N N 38 120.600 120.600 116.127 4.473 18755
165 1 . 1 1 38 38 LEU HA H 38 3.460 3.460 3.828 -0.368 18755
166 1 . 1 1 38 38 LEU C C 38 178.900 178.900 178.678 0.222 18755
167 1 . 1 1 38 38 LEU CA C 38 57.802 57.802 58.004 -0.202 18755
168 1 . 1 1 38 38 LEU CB C 38 39.284 39.284 40.614 -1.330 18755
169 1 . 1 1 38 38 LEU H H 38 8.124 8.124 7.613 0.511 18755
170 1 . 1 1 39 39 LYS N N 39 118.000 118.000 119.147 -1.147 18755
171 1 . 1 1 39 39 LYS HA H 39 4.163 4.163 4.070 0.093 18755
172 1 . 1 1 39 39 LYS C C 39 180.108 180.108 177.734 2.374 18755
173 1 . 1 1 39 39 LYS CA C 39 59.005 59.005 58.732 0.273 18755
174 1 . 1 1 39 39 LYS CB C 39 29.722 29.722 32.228 -2.506 18755
175 1 . 1 1 39 39 LYS H H 39 8.678 8.678 7.669 1.009 18755
176 1 . 1 1 40 40 SER N N 40 116.993 116.993 112.704 4.289 18755
177 1 . 1 1 40 40 SER HA H 40 4.269 4.269 4.322 -0.053 18755
178 1 . 1 1 40 40 SER C C 40 175.000 175.000 175.871 -0.871 18755
179 1 . 1 1 40 40 SER CA C 40 61.287 61.287 60.372 0.915 18755
180 1 . 1 1 40 40 SER CB C 40 62.907 62.907 63.535 -0.628 18755
181 1 . 1 1 40 40 SER H H 40 7.763 7.763 7.919 -0.156 18755
182 1 . 1 1 41 41 VAL N N 41 112.903 112.903 117.381 -4.478 18755
183 1 . 1 1 41 41 VAL HA H 41 4.667 4.667 4.180 0.487 18755
184 1 . 1 1 41 41 VAL C C 41 175.300 175.300 176.856 -1.556 18755
185 1 . 1 1 41 41 VAL CA C 41 60.235 60.235 62.714 -2.479 18755
186 1 . 1 1 41 41 VAL CB C 41 30.615 30.615 32.422 -1.807 18755
187 1 . 1 1 41 41 VAL H H 41 7.143 7.143 7.426 -0.283 18755
188 1 . 1 1 42 42 GLY N N 42 105.906 105.906 106.303 -0.397 18755
189 1 . 1 1 42 42 GLY C C 42 174.300 174.300 173.534 0.766 18755
190 1 . 1 1 42 42 GLY CA C 42 45.132 45.132 44.887 0.245 18755
191 1 . 1 1 42 42 GLY H H 42 7.354 7.354 7.493 -0.139 18755
192 1 . 1 1 43 43 ALA N N 43 125.097 125.097 125.533 -0.436 18755
193 1 . 1 1 43 43 ALA HA H 43 3.901 3.901 3.539 0.362 18755
194 1 . 1 1 43 43 ALA C C 43 177.900 177.900 177.041 0.859 18755
195 1 . 1 1 43 43 ALA CA C 43 53.000 53.000 52.082 0.919 18755
196 1 . 1 1 43 43 ALA CB C 43 18.064 18.064 17.040 1.024 18755
197 1 . 1 1 43 43 ALA H H 43 7.246 7.246 7.873 -0.627 18755
198 1 . 1 1 44 44 GLN N N 44 118.000 118.000 123.217 -5.217 18755
199 1 . 1 1 44 44 GLN H H 44 8.676 8.676 8.201 0.475 18755
200 1 . 1 1 45 45 LYS N N 45 117.985 117.985 121.324 -3.339 18755
201 1 . 1 1 45 45 LYS H H 45 7.247 7.247 7.914 -0.667 18755
202 1 . 1 1 46 46 ASP HA H 46 4.461 4.461 4.324 0.137 18755
203 1 . 1 1 46 46 ASP CA C 46 55.323 55.323 55.874 -0.551 18755
204 1 . 1 1 47 47 THR N N 47 111.306 111.306 108.970 2.336 18755
205 1 . 1 1 47 47 THR HA H 47 4.921 4.921 4.305 0.616 18755
206 1 . 1 1 47 47 THR C C 47 171.900 171.900 172.640 -0.740 18755
207 1 . 1 1 47 47 THR CA C 47 60.259 60.259 60.617 -0.358 18755
208 1 . 1 1 47 47 THR CB C 47 71.478 71.478 71.092 0.386 18755
209 1 . 1 1 47 47 THR H H 47 6.869 6.869 7.305 -0.436 18755
210 1 . 1 1 48 48 TYR N N 48 119.895 119.895 120.532 -0.637 18755
211 1 . 1 1 48 48 TYR HA H 48 4.722 4.722 5.098 -0.376 18755
212 1 . 1 1 48 48 TYR C C 48 175.700 175.700 176.051 -0.351 18755
213 1 . 1 1 48 48 TYR CA C 48 56.966 56.966 55.540 1.426 18755
214 1 . 1 1 48 48 TYR CB C 48 45.567 45.567 41.640 3.927 18755
215 1 . 1 1 48 48 TYR H H 48 8.614 8.614 8.336 0.278 18755
216 1 . 1 1 49 49 THR N N 49 110.720 110.720 113.218 -2.498 18755
217 1 . 1 1 49 49 THR HA H 49 5.318 5.318 4.866 0.452 18755
218 1 . 1 1 49 49 THR C C 49 178.400 178.400 176.090 2.310 18755
219 1 . 1 1 49 49 THR CA C 49 61.019 61.019 60.273 0.746 18755
220 1 . 1 1 49 49 THR CB C 49 71.104 71.104 70.879 0.225 18755
221 1 . 1 1 49 49 THR H H 49 8.761 8.761 8.759 0.002 18755
222 1 . 1 1 50 50 MET N N 50 121.906 121.906 122.118 -0.212 18755
223 1 . 1 1 50 50 MET HA H 50 4.196 4.196 4.104 0.092 18755
224 1 . 1 1 50 50 MET C C 50 178.300 178.300 177.416 0.884 18755
225 1 . 1 1 50 50 MET CA C 50 57.557 57.557 58.967 -1.410 18755
226 1 . 1 1 50 50 MET CB C 50 30.037 30.037 32.412 -2.375 18755
227 1 . 1 1 50 50 MET H H 50 7.901 7.901 9.042 -1.141 18755
228 1 . 1 1 51 51 LYS N N 51 115.600 115.600 118.793 -3.193 18755
229 1 . 1 1 51 51 LYS HA H 51 4.285 4.285 4.236 0.049 18755
230 1 . 1 1 51 51 LYS C C 51 179.100 179.100 178.839 0.261 18755
231 1 . 1 1 51 51 LYS CA C 51 59.322 59.322 58.993 0.329 18755
232 1 . 1 1 51 51 LYS CB C 51 32.140 32.140 32.093 0.047 18755
233 1 . 1 1 51 51 LYS H H 51 8.413 8.413 7.694 0.719 18755
234 1 . 1 1 52 52 GLU N N 52 120.906 120.906 120.394 0.512 18755
235 1 . 1 1 52 52 GLU HA H 52 4.403 4.403 3.819 0.584 18755
236 1 . 1 1 52 52 GLU C C 52 178.200 178.200 178.268 -0.068 18755
237 1 . 1 1 52 52 GLU CA C 52 58.778 58.778 58.920 -0.142 18755
238 1 . 1 1 52 52 GLU CB C 52 31.790 31.790 29.515 2.275 18755
239 1 . 1 1 52 52 GLU H H 52 7.646 7.646 8.001 -0.355 18755
240 1 . 1 1 53 53 VAL N N 53 120.300 120.300 119.878 0.422 18755
241 1 . 1 1 53 53 VAL HA H 53 3.181 3.181 3.753 -0.572 18755
242 1 . 1 1 53 53 VAL C C 53 177.500 177.500 177.954 -0.454 18755
243 1 . 1 1 53 53 VAL CA C 53 67.425 67.425 66.827 0.598 18755
244 1 . 1 1 53 53 VAL CB C 53 30.360 30.360 31.020 -0.660 18755
245 1 . 1 1 53 53 VAL H H 53 7.972 7.972 8.386 -0.414 18755
246 1 . 1 1 54 54 LEU N N 54 120.594 120.594 117.561 3.033 18755
247 1 . 1 1 54 54 LEU HA H 54 3.684 3.684 4.049 -0.365 18755
248 1 . 1 1 54 54 LEU C C 54 178.900 178.900 179.348 -0.448 18755
249 1 . 1 1 54 54 LEU CA C 54 55.110 55.110 56.929 -1.819 18755
250 1 . 1 1 54 54 LEU CB C 54 39.237 39.237 39.820 -0.583 18755
251 1 . 1 1 54 54 LEU H H 54 8.063 8.063 7.740 0.323 18755
252 1 . 1 1 55 55 PHE N N 55 120.300 120.300 120.173 0.127 18755
253 1 . 1 1 55 55 PHE HA H 55 3.951 3.951 4.092 -0.141 18755
254 1 . 1 1 55 55 PHE C C 55 177.900 177.900 177.250 0.650 18755
255 1 . 1 1 55 55 PHE CA C 55 61.017 61.017 61.937 -0.920 18755
256 1 . 1 1 55 55 PHE CB C 55 38.083 38.083 38.910 -0.827 18755
257 1 . 1 1 55 55 PHE H H 55 7.339 7.339 7.414 -0.075 18755
258 1 . 1 1 56 56 TYR N N 56 119.500 119.500 117.108 2.392 18755
259 1 . 1 1 56 56 TYR HA H 56 3.740 3.740 3.967 -0.227 18755
260 1 . 1 1 56 56 TYR C C 56 178.200 178.200 178.253 -0.053 18755
261 1 . 1 1 56 56 TYR CA C 56 62.737 62.737 60.973 1.764 18755
262 1 . 1 1 56 56 TYR CB C 56 38.869 38.869 37.380 1.489 18755
263 1 . 1 1 56 56 TYR H H 56 8.074 8.074 7.322 0.752 18755
264 1 . 1 1 57 57 LEU N N 57 119.895 119.895 119.568 0.327 18755
265 1 . 1 1 57 57 LEU HA H 57 3.858 3.858 4.051 -0.193 18755
266 1 . 1 1 57 57 LEU C C 57 178.800 178.800 179.723 -0.923 18755
267 1 . 1 1 57 57 LEU CA C 57 57.567 57.567 57.988 -0.421 18755
268 1 . 1 1 57 57 LEU CB C 57 42.158 42.158 41.355 0.803 18755
269 1 . 1 1 57 57 LEU H H 57 8.628 8.628 8.273 0.355 18755
270 1 . 1 1 58 58 GLY N N 58 107.015 107.015 106.469 0.546 18755
271 1 . 1 1 58 58 GLY C C 58 175.028 175.028 176.006 -0.978 18755
272 1 . 1 1 58 58 GLY CA C 58 47.103 47.103 46.915 0.188 18755
273 1 . 1 1 58 58 GLY H H 58 8.245 8.245 8.237 0.008 18755
274 1 . 1 1 59 59 GLN N N 59 119.400 119.400 121.107 -1.707 18755
275 1 . 1 1 59 59 GLN HA H 59 3.793 3.793 3.957 -0.164 18755
276 1 . 1 1 59 59 GLN C C 59 178.900 178.900 177.248 1.652 18755
277 1 . 1 1 59 59 GLN CA C 59 58.023 58.023 58.107 -0.084 18755
278 1 . 1 1 59 59 GLN CB C 59 28.883 28.883 28.504 0.379 18755
279 1 . 1 1 59 59 GLN H H 59 7.400 7.400 8.207 -0.807 18755
280 1 . 1 1 60 60 TYR N N 60 123.589 123.589 121.999 1.590 18755
281 1 . 1 1 60 60 TYR HA H 60 3.687 3.687 4.111 -0.424 18755
282 1 . 1 1 60 60 TYR C C 60 175.700 175.700 177.536 -1.836 18755
283 1 . 1 1 60 60 TYR CA C 60 62.621 62.621 61.075 1.546 18755
284 1 . 1 1 60 60 TYR CB C 60 38.069 38.069 38.103 -0.034 18755
285 1 . 1 1 60 60 TYR H H 60 8.521 8.521 8.126 0.395 18755
286 1 . 1 1 61 61 ILE N N 61 118.996 118.996 118.455 0.541 18755
287 1 . 1 1 61 61 ILE HA H 61 3.125 3.125 3.317 -0.192 18755
288 1 . 1 1 61 61 ILE C C 61 177.600 177.600 177.719 -0.119 18755
289 1 . 1 1 61 61 ILE CA C 61 65.908 65.908 65.542 0.366 18755
290 1 . 1 1 61 61 ILE CB C 61 38.093 38.093 37.502 0.591 18755
291 1 . 1 1 61 61 ILE H H 61 8.240 8.240 7.524 0.716 18755
292 1 . 1 1 62 62 MET N N 62 115.500 115.500 117.951 -2.451 18755
293 1 . 1 1 62 62 MET HA H 62 4.333 4.333 3.929 0.404 18755
294 1 . 1 1 62 62 MET C C 62 180.000 180.000 178.044 1.956 18755
295 1 . 1 1 62 62 MET CA C 62 57.270 57.270 58.834 -1.564 18755
296 1 . 1 1 62 62 MET CB C 62 30.961 30.961 32.618 -1.657 18755
297 1 . 1 1 62 62 MET H H 62 7.750 7.750 7.322 0.428 18755
298 1 . 1 1 63 63 THR N N 63 117.070 117.070 112.559 4.511 18755
299 1 . 1 1 63 63 THR HA H 63 3.865 3.865 4.139 -0.274 18755
300 1 . 1 1 63 63 THR C C 63 176.200 176.200 176.132 0.068 18755
301 1 . 1 1 63 63 THR CA C 63 65.992 65.992 64.839 1.153 18755
302 1 . 1 1 63 63 THR CB C 63 68.857 68.857 69.096 -0.239 18755
303 1 . 1 1 63 63 THR H H 63 8.423 8.423 7.936 0.487 18755
304 1 . 1 1 64 64 LYS N N 64 118.512 118.512 119.162 -0.650 18755
305 1 . 1 1 64 64 LYS HA H 64 3.954 3.954 4.322 -0.368 18755
306 1 . 1 1 64 64 LYS C C 64 174.500 174.500 176.026 -1.526 18755
307 1 . 1 1 64 64 LYS CA C 64 55.027 55.027 55.265 -0.238 18755
308 1 . 1 1 64 64 LYS CB C 64 30.673 30.673 32.770 -2.097 18755
309 1 . 1 1 64 64 LYS H H 64 7.678 7.678 7.832 -0.154 18755
310 1 . 1 1 65 65 ARG N N 65 115.400 115.400 116.242 -0.842 18755
311 1 . 1 1 65 65 ARG HA H 65 3.764 3.764 4.096 -0.332 18755
312 1 . 1 1 65 65 ARG C C 65 175.900 175.900 176.612 -0.712 18755
313 1 . 1 1 65 65 ARG CA C 65 56.475 56.475 56.773 -0.298 18755
314 1 . 1 1 65 65 ARG CB C 65 25.911 25.911 27.006 -1.095 18755
315 1 . 1 1 65 65 ARG H H 65 7.467 7.467 7.835 -0.368 18755
316 1 . 1 1 66 66 LEU N N 66 115.591 115.591 116.519 -0.928 18755
317 1 . 1 1 66 66 LEU HA H 66 4.335 4.335 4.161 0.174 18755
318 1 . 1 1 66 66 LEU C C 66 175.400 175.400 177.133 -1.733 18755
319 1 . 1 1 66 66 LEU CA C 66 54.526 54.526 55.930 -1.404 18755
320 1 . 1 1 66 66 LEU CB C 66 41.682 41.682 41.772 -0.090 18755
321 1 . 1 1 66 66 LEU H H 66 7.612 7.612 7.554 0.058 18755
322 1 . 1 1 67 67 TYR N N 67 116.298 116.298 115.624 0.674 18755
323 1 . 1 1 67 67 TYR HA H 67 4.751 4.751 4.359 0.392 18755
324 1 . 1 1 67 67 TYR C C 67 173.576 173.576 175.137 -1.561 18755
325 1 . 1 1 67 67 TYR CA C 67 55.334 55.334 54.809 0.524 18755
326 1 . 1 1 67 67 TYR CB C 67 40.410 40.410 37.661 2.749 18755
327 1 . 1 1 67 67 TYR H H 67 7.127 7.127 7.485 -0.358 18755
328 1 . 1 1 68 68 ASP N N 68 124.792 124.792 124.283 0.509 18755
329 1 . 1 1 68 68 ASP C C 68 175.741 175.741 175.301 0.440 18755
330 1 . 1 1 68 68 ASP CA C 68 53.209 53.209 53.613 -0.404 18755
331 1 . 1 1 68 68 ASP CB C 68 42.503 42.503 41.605 0.898 18755
332 1 . 1 1 68 68 ASP H H 68 8.205 8.205 8.491 -0.286 18755
333 1 . 1 1 69 69 GLU N N 69 123.507 123.507 121.254 2.253 18755
334 1 . 1 1 69 69 GLU HA H 69 3.797 3.797 4.600 -0.803 18755
335 1 . 1 1 69 69 GLU C C 69 176.859 176.859 176.445 0.414 18755
336 1 . 1 1 69 69 GLU CA C 69 57.980 57.980 54.716 3.264 18755
337 1 . 1 1 69 69 GLU CB C 69 29.260 29.260 29.037 0.223 18755
338 1 . 1 1 69 69 GLU H H 69 8.440 8.440 8.260 0.180 18755
339 1 . 1 1 70 70 LYS N N 70 117.904 117.904 122.092 -4.188 18755
340 1 . 1 1 70 70 LYS HA H 70 4.325 4.325 3.973 0.352 18755
341 1 . 1 1 70 70 LYS C C 70 177.016 177.016 177.589 -0.573 18755
342 1 . 1 1 70 70 LYS CA C 70 57.040 57.040 58.586 -1.546 18755
343 1 . 1 1 70 70 LYS CB C 70 32.090 32.090 32.060 0.030 18755
344 1 . 1 1 70 70 LYS H H 70 8.208 8.208 8.502 -0.294 18755
345 1 . 1 1 71 71 GLN N N 71 118.762 118.762 117.769 0.993 18755
346 1 . 1 1 71 71 GLN HA H 71 4.325 4.325 4.203 0.122 18755
347 1 . 1 1 71 71 GLN C C 71 175.300 175.300 176.430 -1.130 18755
348 1 . 1 1 71 71 GLN CA C 71 54.920 54.920 57.118 -2.198 18755
349 1 . 1 1 71 71 GLN CB C 71 28.850 28.850 29.266 -0.416 18755
350 1 . 1 1 71 71 GLN H H 71 7.934 7.934 8.189 -0.255 18755
351 1 . 1 1 72 72 GLN N N 72 118.200 118.200 117.515 0.685 18755
352 1 . 1 1 72 72 GLN HA H 72 4.035 4.035 4.237 -0.202 18755
353 1 . 1 1 72 72 GLN C C 72 175.022 175.022 175.648 -0.626 18755
354 1 . 1 1 72 72 GLN CA C 72 57.210 57.210 55.144 2.066 18755
355 1 . 1 1 72 72 GLN CB C 72 27.880 27.880 30.338 -2.458 18755
356 1 . 1 1 72 72 GLN H H 72 8.051 8.051 8.005 0.046 18755
357 1 . 1 1 74 74 ILE N N 74 120.607 120.607 121.037 -0.430 18755
358 1 . 1 1 74 74 ILE HA H 74 4.313 4.313 3.744 0.569 18755
359 1 . 1 1 74 74 ILE C C 74 174.400 174.400 174.936 -0.536 18755
360 1 . 1 1 74 74 ILE CA C 74 58.521 58.521 62.577 -4.056 18755
361 1 . 1 1 74 74 ILE CB C 74 38.242 38.242 39.089 -0.847 18755
362 1 . 1 1 75 75 VAL N N 75 126.197 126.197 122.784 3.413 18755
363 1 . 1 1 75 75 VAL HA H 75 3.760 3.760 4.393 -0.633 18755
364 1 . 1 1 75 75 VAL C C 75 174.100 174.100 173.572 0.528 18755
365 1 . 1 1 75 75 VAL CA C 75 60.538 60.538 59.038 1.500 18755
366 1 . 1 1 75 75 VAL CB C 75 31.759 31.759 34.716 -2.957 18755
367 1 . 1 1 75 75 VAL H H 75 8.274 8.274 7.631 0.643 18755
368 1 . 1 1 76 76 TYR N N 76 126.301 126.301 124.888 1.413 18755
369 1 . 1 1 76 76 TYR HA H 76 4.569 4.569 5.477 -0.908 18755
370 1 . 1 1 76 76 TYR C C 76 175.000 175.000 176.121 -1.121 18755
371 1 . 1 1 76 76 TYR CA C 76 57.648 57.648 56.099 1.549 18755
372 1 . 1 1 76 76 TYR CB C 76 38.188 38.188 41.066 -2.878 18755
373 1 . 1 1 76 76 TYR H H 76 8.110 8.110 7.823 0.287 18755
374 1 . 1 1 77 77 CYS N N 77 117.781 117.781 118.543 -0.762 18755
375 1 . 1 1 77 77 CYS HA H 77 4.782 4.782 4.779 0.003 18755
376 1 . 1 1 77 77 CYS C C 77 173.429 173.429 174.123 -0.694 18755
377 1 . 1 1 77 77 CYS CA C 77 55.361 55.361 57.722 -2.361 18755
378 1 . 1 1 77 77 CYS CB C 77 29.255 29.255 30.145 -0.891 18755
379 1 . 1 1 77 77 CYS H H 77 8.295 8.295 8.530 -0.235 18755
380 1 . 1 1 78 78 SER N N 78 116.896 116.896 118.273 -1.377 18755
381 1 . 1 1 78 78 SER HA H 78 4.182 4.182 4.675 -0.493 18755
382 1 . 1 1 78 78 SER CA C 78 60.064 60.064 57.905 2.159 18755
383 1 . 1 1 78 78 SER CB C 78 63.122 63.122 64.300 -1.178 18755
384 1 . 1 1 78 78 SER H H 78 7.585 7.585 8.560 -0.975 18755
385 1 . 1 1 79 79 ASN N N 79 118.100 118.100 118.979 -0.879 18755
386 1 . 1 1 79 79 ASN HA H 79 4.631 4.631 4.754 -0.123 18755
387 1 . 1 1 79 79 ASN C C 79 172.700 172.700 174.119 -1.419 18755
388 1 . 1 1 79 79 ASN CA C 79 52.850 52.850 53.655 -0.805 18755
389 1 . 1 1 79 79 ASN CB C 79 37.796 37.796 38.743 -0.947 18755
390 1 . 1 1 79 79 ASN H H 79 8.609 8.609 8.479 0.130 18755
391 1 . 1 1 80 80 ASP N N 80 118.603 118.603 118.894 -0.291 18755
392 1 . 1 1 80 80 ASP HA H 80 4.774 4.774 4.774 0.000 18755
393 1 . 1 1 80 80 ASP C C 80 174.900 174.900 177.656 -2.756 18755
394 1 . 1 1 80 80 ASP CA C 80 52.802 52.802 53.923 -1.121 18755
395 1 . 1 1 80 80 ASP CB C 80 47.221 47.221 42.575 4.646 18755
396 1 . 1 1 80 80 ASP H H 80 7.549 7.549 7.842 -0.293 18755
397 1 . 1 1 81 81 LEU N N 81 129.094 129.094 119.896 9.198 18755
398 1 . 1 1 81 81 LEU HA H 81 4.109 4.109 4.401 -0.292 18755
399 1 . 1 1 81 81 LEU C C 81 177.800 177.800 177.832 -0.032 18755
400 1 . 1 1 81 81 LEU CA C 81 57.666 57.666 57.051 0.615 18755
401 1 . 1 1 81 81 LEU CB C 81 42.026 42.026 41.448 0.578 18755
402 1 . 1 1 81 81 LEU H H 81 8.411 8.411 9.014 -0.603 18755
403 1 . 1 1 82 82 LEU N N 82 118.601 118.601 121.671 -3.070 18755
404 1 . 1 1 82 82 LEU HA H 82 3.464 3.464 4.225 -0.761 18755
405 1 . 1 1 82 82 LEU C C 82 178.100 178.100 178.342 -0.242 18755
406 1 . 1 1 82 82 LEU CA C 82 57.811 57.811 56.224 1.587 18755
407 1 . 1 1 82 82 LEU CB C 82 42.416 42.416 40.929 1.487 18755
408 1 . 1 1 82 82 LEU H H 82 9.777 9.777 8.248 1.529 18755
409 1 . 1 1 83 83 GLY N N 83 105.800 105.800 105.921 -0.121 18755
410 1 . 1 1 83 83 GLY C C 83 176.900 176.900 175.498 1.402 18755
411 1 . 1 1 83 83 GLY CA C 83 47.554 47.554 46.485 1.069 18755
412 1 . 1 1 83 83 GLY H H 83 7.592 7.592 7.821 -0.229 18755
413 1 . 1 1 84 84 ASP N N 84 123.089 123.089 121.793 1.296 18755
414 1 . 1 1 84 84 ASP HA H 84 4.282 4.282 4.456 -0.174 18755
415 1 . 1 1 84 84 ASP C C 84 178.600 178.600 177.347 1.253 18755
416 1 . 1 1 84 84 ASP CA C 84 56.580 56.580 56.794 -0.214 18755
417 1 . 1 1 84 84 ASP CB C 84 39.895 39.895 40.605 -0.710 18755
418 1 . 1 1 84 84 ASP H H 84 7.366 7.366 8.324 -0.958 18755
419 1 . 1 1 85 85 LEU N N 85 118.800 118.800 118.548 0.252 18755
420 1 . 1 1 85 85 LEU HA H 85 3.987 3.987 3.924 0.063 18755
421 1 . 1 1 85 85 LEU C C 85 178.900 178.900 178.260 0.640 18755
422 1 . 1 1 85 85 LEU CA C 85 56.984 56.984 56.983 0.001 18755
423 1 . 1 1 85 85 LEU CB C 85 41.221 41.221 41.857 -0.636 18755
424 1 . 1 1 85 85 LEU H H 85 7.981 7.981 7.358 0.623 18755
425 1 . 1 1 86 86 PHE N N 86 117.812 117.812 115.191 2.621 18755
426 1 . 1 1 86 86 PHE HA H 86 4.402 4.402 4.297 0.105 18755
427 1 . 1 1 86 86 PHE C C 86 176.400 176.400 177.412 -1.012 18755
428 1 . 1 1 86 86 PHE CA C 86 55.833 55.833 59.226 -3.393 18755
429 1 . 1 1 86 86 PHE CB C 86 37.328 37.328 39.337 -2.009 18755
430 1 . 1 1 86 86 PHE H H 86 8.531 8.531 7.416 1.115 18755
431 1 . 1 1 87 87 GLY N N 87 107.899 107.899 107.557 0.342 18755
432 1 . 1 1 87 87 GLY C C 87 173.800 173.800 174.018 -0.218 18755
433 1 . 1 1 87 87 GLY CA C 87 45.887 45.887 45.705 0.183 18755
434 1 . 1 1 87 87 GLY H H 87 8.150 8.150 8.032 0.118 18755
435 1 . 1 1 88 88 VAL N N 88 108.596 108.596 114.091 -5.495 18755
436 1 . 1 1 88 88 VAL HA H 88 4.897 4.897 4.792 0.105 18755
437 1 . 1 1 88 88 VAL C C 88 174.100 174.100 174.342 -0.242 18755
438 1 . 1 1 88 88 VAL CA C 88 56.703 56.703 58.089 -1.386 18755
439 1 . 1 1 88 88 VAL CB C 88 34.799 34.799 33.416 1.383 18755
440 1 . 1 1 88 88 VAL H H 88 7.073 7.073 7.567 -0.494 18755
441 1 . 1 1 89 89 PRO HA H 89 4.342 4.342 4.613 -0.271 18755
442 1 . 1 1 89 89 PRO CA C 89 62.880 62.880 64.484 -1.604 18755
443 1 . 1 1 89 89 PRO CB C 89 31.620 31.620 32.236 -0.616 18755
444 1 . 1 1 90 90 SER N N 90 110.799 110.799 114.179 -3.380 18755
445 1 . 1 1 90 90 SER HA H 90 5.362 5.362 4.905 0.457 18755
446 1 . 1 1 90 90 SER C C 90 172.300 172.300 173.326 -1.026 18755
447 1 . 1 1 90 90 SER CA C 90 56.470 56.470 56.659 -0.188 18755
448 1 . 1 1 90 90 SER CB C 90 64.481 64.481 65.084 -0.603 18755
449 1 . 1 1 90 90 SER H H 90 7.115 7.115 7.636 -0.521 18755
450 1 . 1 1 91 91 PHE N N 91 112.909 112.909 121.295 -8.386 18755
451 1 . 1 1 91 91 PHE HA H 91 4.761 4.761 4.828 -0.067 18755
452 1 . 1 1 91 91 PHE C C 91 171.600 171.600 174.714 -3.114 18755
453 1 . 1 1 91 91 PHE CA C 91 56.549 56.549 55.378 1.171 18755
454 1 . 1 1 91 91 PHE CB C 91 39.765 39.765 40.304 -0.539 18755
455 1 . 1 1 91 91 PHE H H 91 8.008 8.008 8.114 -0.106 18755
456 1 . 1 1 92 92 SER N N 92 113.293 113.293 119.976 -6.683 18755
457 1 . 1 1 92 92 SER HA H 92 5.184 5.184 4.426 0.758 18755
458 1 . 1 1 92 92 SER C C 92 177.900 177.900 175.414 2.486 18755
459 1 . 1 1 92 92 SER CA C 92 55.256 55.256 58.081 -2.825 18755
460 1 . 1 1 92 92 SER CB C 92 63.592 63.592 62.539 1.053 18755
461 1 . 1 1 92 92 SER H H 92 8.708 8.708 8.853 -0.145 18755
462 1 . 1 1 93 93 VAL N N 93 121.309 121.309 125.758 -4.449 18755
463 1 . 1 1 93 93 VAL HA H 93 4.306 4.306 3.777 0.529 18755
464 1 . 1 1 93 93 VAL C C 93 173.760 173.760 175.468 -1.708 18755
465 1 . 1 1 93 93 VAL CA C 93 63.973 63.973 65.398 -1.425 18755
466 1 . 1 1 93 93 VAL CB C 93 31.402 31.402 32.082 -0.680 18755
467 1 . 1 1 93 93 VAL H H 93 8.879 8.879 7.950 0.929 18755
468 1 . 1 1 94 94 LYS N N 94 113.118 113.118 113.198 -0.080 18755
469 1 . 1 1 94 94 LYS HA H 94 4.380 4.380 3.991 0.389 18755
470 1 . 1 1 94 94 LYS C C 94 177.300 177.300 176.464 0.836 18755
471 1 . 1 1 94 94 LYS CA C 94 55.036 55.036 56.925 -1.889 18755
472 1 . 1 1 94 94 LYS CB C 94 32.231 32.231 31.938 0.293 18755
473 1 . 1 1 94 94 LYS H H 94 7.836 7.836 8.010 -0.174 18755
474 1 . 1 1 95 95 GLU N N 95 119.700 119.700 120.895 -1.195 18755
475 1 . 1 1 95 95 GLU HA H 95 4.485 4.485 4.461 0.024 18755
476 1 . 1 1 95 95 GLU C C 95 176.100 176.100 176.377 -0.277 18755
477 1 . 1 1 95 95 GLU CA C 95 54.586 54.586 54.747 -0.161 18755
478 1 . 1 1 95 95 GLU CB C 95 27.942 27.942 27.805 0.137 18755
479 1 . 1 1 95 95 GLU H H 95 6.901 6.901 7.865 -0.964 18755
480 1 . 1 1 96 96 HIS N N 96 121.512 121.512 120.518 0.994 18755
481 1 . 1 1 96 96 HIS HA H 96 4.357 4.357 4.138 0.219 18755
482 1 . 1 1 96 96 HIS C C 96 177.300 177.300 177.099 0.201 18755
483 1 . 1 1 96 96 HIS CA C 96 58.495 58.495 60.922 -2.427 18755
484 1 . 1 1 96 96 HIS CB C 96 30.965 30.965 29.677 1.288 18755
485 1 . 1 1 96 96 HIS H H 96 7.568 7.568 6.846 0.722 18755
486 1 . 1 1 97 97 ARG N N 97 120.300 120.300 119.053 1.247 18755
487 1 . 1 1 97 97 ARG HA H 97 3.888 3.888 3.982 -0.094 18755
488 1 . 1 1 97 97 ARG C C 97 177.800 177.800 177.602 0.198 18755
489 1 . 1 1 97 97 ARG CA C 97 57.432 57.432 59.344 -1.912 18755
490 1 . 1 1 97 97 ARG CB C 97 25.850 25.850 29.762 -3.912 18755
491 1 . 1 1 98 98 LYS N N 98 120.600 120.600 119.461 1.139 18755
492 1 . 1 1 98 98 LYS C C 98 178.500 178.500 179.199 -0.699 18755
493 1 . 1 1 98 98 LYS CA C 98 60.070 60.070 59.558 0.512 18755
494 1 . 1 1 98 98 LYS CB C 98 31.820 31.820 32.730 -0.910 18755
495 1 . 1 1 98 98 LYS H H 98 7.741 7.741 8.056 -0.315 18755
496 1 . 1 1 99 99 ILE N N 99 119.394 119.394 118.505 0.889 18755
497 1 . 1 1 99 99 ILE HA H 99 3.017 3.017 3.985 -0.968 18755
498 1 . 1 1 99 99 ILE C C 99 177.000 177.000 178.275 -1.275 18755
499 1 . 1 1 99 99 ILE CA C 99 65.864 65.864 65.249 0.615 18755
500 1 . 1 1 99 99 ILE CB C 99 37.684 37.684 37.614 0.070 18755
501 1 . 1 1 99 99 ILE H H 99 7.585 7.585 8.073 -0.488 18755
502 1 . 1 1 100 100 TYR N N 100 121.894 121.894 119.998 1.896 18755
503 1 . 1 1 100 100 TYR HA H 100 3.193 3.193 4.221 -1.028 18755
504 1 . 1 1 100 100 TYR C C 100 176.500 176.500 178.362 -1.862 18755
505 1 . 1 1 100 100 TYR CA C 100 63.706 63.706 62.329 1.377 18755
506 1 . 1 1 100 100 TYR CB C 100 37.142 37.142 37.969 -0.827 18755
507 1 . 1 1 100 100 TYR H H 100 8.430 8.430 8.947 -0.517 18755
508 1 . 1 1 101 101 THR N N 101 113.693 113.693 114.510 -0.817 18755
509 1 . 1 1 101 101 THR HA H 101 3.805 3.805 4.141 -0.336 18755
510 1 . 1 1 101 101 THR C C 101 176.100 176.100 175.884 0.216 18755
511 1 . 1 1 101 101 THR CA C 101 67.003 67.003 66.642 0.361 18755
512 1 . 1 1 101 101 THR CB C 101 68.496 68.496 68.674 -0.178 18755
513 1 . 1 1 101 101 THR H H 101 8.232 8.232 7.961 0.271 18755
514 1 . 1 1 102 102 MET N N 102 119.500 119.500 118.139 1.361 18755
515 1 . 1 1 102 102 MET C C 102 178.000 178.000 178.764 -0.764 18755
516 1 . 1 1 102 102 MET CA C 102 59.360 59.360 57.457 1.903 18755
517 1 . 1 1 102 102 MET CB C 102 31.110 31.110 32.141 -1.030 18755
518 1 . 1 1 102 102 MET H H 102 7.461 7.461 7.661 -0.200 18755
519 1 . 1 1 103 103 ILE N N 103 120.103 120.103 120.365 -0.262 18755
520 1 . 1 1 103 103 ILE HA H 103 3.163 3.163 3.542 -0.379 18755
521 1 . 1 1 103 103 ILE C C 103 178.700 178.700 178.362 0.338 18755
522 1 . 1 1 103 103 ILE CA C 103 66.114 66.114 64.992 1.122 18755
523 1 . 1 1 103 103 ILE CB C 103 37.384 37.384 37.555 -0.171 18755
524 1 . 1 1 103 103 ILE H H 103 7.824 7.824 8.043 -0.219 18755
525 1 . 1 1 104 104 TYR N N 104 119.500 119.500 118.854 0.646 18755
526 1 . 1 1 104 104 TYR HA H 104 4.066 4.066 4.302 -0.236 18755
527 1 . 1 1 104 104 TYR C C 104 177.300 177.300 175.568 1.732 18755
528 1 . 1 1 104 104 TYR CA C 104 60.505 60.505 59.931 0.574 18755
529 1 . 1 1 104 104 TYR CB C 104 37.643 37.643 38.498 -0.855 18755
530 1 . 1 1 104 104 TYR H H 104 8.694 8.694 8.656 0.038 18755
531 1 . 1 1 105 105 ARG N N 105 114.400 114.400 117.256 -2.856 18755
532 1 . 1 1 105 105 ARG HA H 105 4.237 4.237 4.202 0.034 18755
533 1 . 1 1 105 105 ARG C C 105 176.500 176.500 175.679 0.821 18755
534 1 . 1 1 105 105 ARG CA C 105 58.128 58.128 55.601 2.527 18755
535 1 . 1 1 105 105 ARG CB C 105 30.266 30.266 30.835 -0.569 18755
536 1 . 1 1 105 105 ARG H H 105 6.713 6.713 7.571 -0.858 18755
537 1 . 1 1 106 106 ASN N N 106 116.011 116.011 118.035 -2.024 18755
538 1 . 1 1 106 106 ASN HA H 106 4.834 4.834 4.815 0.019 18755
539 1 . 1 1 106 106 ASN C C 106 171.800 171.800 173.314 -1.514 18755
540 1 . 1 1 106 106 ASN CA C 106 53.484 53.484 53.088 0.396 18755
541 1 . 1 1 106 106 ASN CB C 106 41.946 41.946 40.569 1.377 18755
542 1 . 1 1 106 106 ASN H H 106 8.396 8.396 7.905 0.491 18755
543 1 . 1 1 107 107 LEU N N 107 115.594 115.594 116.203 -0.609 18755
544 1 . 1 1 107 107 LEU HA H 107 4.779 4.779 4.839 -0.060 18755
545 1 . 1 1 107 107 LEU C C 107 173.500 173.500 174.847 -1.347 18755
546 1 . 1 1 107 107 LEU CA C 107 54.230 54.230 52.941 1.289 18755
547 1 . 1 1 107 107 LEU CB C 107 45.490 45.490 44.059 1.431 18755
548 1 . 1 1 107 107 LEU H H 107 7.551 7.551 7.294 0.257 18755
549 1 . 1 1 108 108 VAL N N 108 117.493 117.493 121.693 -4.200 18755
550 1 . 1 1 108 108 VAL HA H 108 4.314 4.314 4.366 -0.052 18755
551 1 . 1 1 108 108 VAL C C 108 175.100 175.100 175.072 0.028 18755
552 1 . 1 1 108 108 VAL CA C 108 60.620 60.620 60.790 -0.170 18755
553 1 . 1 1 108 108 VAL CB C 108 34.322 34.322 31.414 2.908 18755
554 1 . 1 1 108 108 VAL H H 108 7.906 7.906 8.591 -0.685 18755
555 1 . 1 1 109 109 VAL N N 109 128.100 128.100 123.743 4.357 18755
556 1 . 1 1 109 109 VAL HA H 109 3.979 3.979 4.240 -0.261 18755
557 1 . 1 1 109 109 VAL C C 109 176.000 176.000 175.553 0.447 18755
558 1 . 1 1 109 109 VAL CA C 109 63.319 63.319 62.632 0.687 18755
559 1 . 1 1 109 109 VAL CB C 109 31.909 31.909 32.069 -0.160 18755
560 1 . 1 1 109 109 VAL H H 109 8.740 8.740 8.458 0.282 18755
561 1 . 1 1 110 110 VAL N N 110 127.704 127.704 124.391 3.313 18755
562 1 . 1 1 110 110 VAL HA H 110 3.785 3.785 4.159 -0.374 18755
563 1 . 1 1 110 110 VAL C C 110 175.300 175.300 176.210 -0.910 18755
564 1 . 1 1 110 110 VAL CB C 110 31.890 31.890 32.547 -0.657 18755
565 1 . 1 1 110 110 VAL H H 110 8.283 8.283 8.770 -0.487 18755
566 1 . 1 1 111 111 ASN N N 111 122.500 122.500 118.114 4.386 18755
567 1 . 1 1 111 111 ASN HA H 111 4.626 4.626 4.934 -0.308 18755
568 1 . 1 1 111 111 ASN C C 111 174.728 174.728 173.588 1.140 18755
569 1 . 1 1 111 111 ASN CA C 111 52.818 52.818 52.748 0.070 18755
570 1 . 1 1 111 111 ASN CB C 111 38.664 38.664 40.652 -1.988 18755
571 1 . 1 1 111 111 ASN H H 111 8.488 8.488 8.236 0.252 18755
572 1 . 1 1 112 112 GLN N N 112 121.700 121.700 120.081 1.619 18755
573 1 . 1 1 112 112 GLN HA H 112 4.194 4.194 4.708 -0.514 18755
574 1 . 1 1 112 112 GLN C C 112 175.600 175.600 175.364 0.236 18755
575 1 . 1 1 112 112 GLN CA C 112 55.958 55.958 54.968 0.990 18755
576 1 . 1 1 112 112 GLN CB C 112 29.975 29.975 31.289 -1.314 18755
577 1 . 1 1 112 112 GLN H H 112 8.366 8.366 8.397 -0.031 18755
578 1 . 1 1 113 113 GLN N N 113 122.200 122.200 119.675 2.525 18755
579 1 . 1 1 113 113 GLN C C 113 176.200 176.200 175.255 0.945 18755
580 1 . 1 1 113 113 GLN CA C 113 56.500 56.500 56.254 0.246 18755
581 1 . 1 1 113 113 GLN CB C 113 30.030 30.030 29.743 0.287 18755
582 1 . 1 1 113 113 GLN H H 113 8.331 8.331 8.600 -0.269 18755
583 1 . 1 1 115 115 SER N N 115 116.889 116.889 115.037 1.852 18755
584 1 . 1 1 115 115 SER HA H 115 4.392 4.392 4.614 -0.222 18755
585 1 . 1 1 115 115 SER C C 115 174.412 174.412 174.359 0.053 18755
586 1 . 1 1 115 115 SER CA C 115 57.837 57.837 58.546 -0.709 18755
587 1 . 1 1 115 115 SER CB C 115 63.574 63.574 63.827 -0.253 18755
588 1 . 1 1 115 115 SER H H 115 8.302 8.302 8.286 0.016 18755
589 1 . 1 1 116 116 SER N N 116 118.000 118.000 116.610 1.390 18755
590 1 . 1 1 116 116 SER HA H 116 4.381 4.381 4.588 -0.207 18755
591 1 . 1 1 116 116 SER C C 116 174.100 174.100 173.118 0.982 18755
592 1 . 1 1 116 116 SER CA C 116 58.062 58.062 57.417 0.645 18755
593 1 . 1 1 116 116 SER CB C 116 63.460 63.460 64.435 -0.975 18755
594 1 . 1 1 116 116 SER H H 116 8.350 8.350 7.937 0.413 18755
595 1 . 1 1 117 117 ASP N N 117 122.400 122.400 122.241 0.159 18755
596 1 . 1 1 117 117 ASP HA H 117 4.551 4.551 4.692 -0.141 18755
597 1 . 1 1 117 117 ASP C C 117 176.200 176.200 175.548 0.652 18755
598 1 . 1 1 117 117 ASP CA C 117 54.140 54.140 54.637 -0.497 18755
599 1 . 1 1 117 117 ASP CB C 117 40.980 40.980 41.441 -0.461 18755
600 1 . 1 1 117 117 ASP H H 117 8.274 8.274 8.481 -0.207 18755
601 1 . 1 1 118 118 SER N N 118 116.593 116.593 117.833 -1.240 18755
602 1 . 1 1 118 118 SER HA H 118 4.296 4.296 4.691 -0.395 18755
603 1 . 1 1 118 118 SER C C 118 175.000 175.000 174.528 0.472 18755
604 1 . 1 1 118 118 SER CA C 118 58.660 58.660 57.952 0.708 18755
605 1 . 1 1 118 118 SER CB C 118 63.550 63.550 64.512 -0.962 18755
606 1 . 1 1 118 118 SER H H 118 8.210 8.210 8.541 -0.331 18755
607 1 . 1 1 119 119 GLY N N 119 110.896 110.896 111.608 -0.712 18755
608 1 . 1 1 119 119 GLY C C 119 174.100 174.100 174.005 0.095 18755
609 1 . 1 1 119 119 GLY CA C 119 45.180 45.180 45.388 -0.208 18755
610 1 . 1 1 119 119 GLY H H 119 8.376 8.376 8.448 -0.072 18755
611 1 . 1 1 120 120 THR N N 120 113.503 113.503 112.929 0.574 18755
612 1 . 1 1 120 120 THR HA H 120 4.255 4.255 4.557 -0.302 18755
613 1 . 1 1 120 120 THR C C 120 174.385 174.385 174.021 0.364 18755
614 1 . 1 1 120 120 THR CA C 120 61.490 61.490 61.266 0.224 18755
615 1 . 1 1 120 120 THR CB C 120 69.690 69.690 70.417 -0.727 18755
616 1 . 1 1 120 120 THR H H 120 7.932 7.932 8.104 -0.172 18755
617 1 . 1 1 121 121 SER N N 121 118.800 118.800 117.869 0.931 18755
618 1 . 1 1 121 121 SER HA H 121 4.354 4.354 4.727 -0.373 18755
619 1 . 1 1 121 121 SER C C 121 174.120 174.120 173.510 0.610 18755
620 1 . 1 1 121 121 SER CA C 121 57.876 57.876 57.623 0.253 18755
621 1 . 1 1 121 121 SER CB C 121 63.650 63.650 64.356 -0.706 18755
622 1 . 1 1 121 121 SER H H 121 8.284 8.284 8.212 0.072 18755
623 1 . 1 1 122 122 VAL N N 122 121.801 121.801 121.020 0.781 18755
624 1 . 1 1 122 122 VAL HA H 122 4.070 4.070 4.426 -0.356 18755
625 1 . 1 1 122 122 VAL C C 122 175.900 175.900 174.652 1.248 18755
626 1 . 1 1 122 122 VAL CA C 122 61.859 61.859 61.696 0.163 18755
627 1 . 1 1 122 122 VAL CB C 122 32.315 32.315 33.410 -1.095 18755
628 1 . 1 1 122 122 VAL H H 122 8.131 8.131 8.507 -0.376 18755
629 1 . 1 1 123 123 SER N N 123 119.593 119.593 121.913 -2.320 18755
630 1 . 1 1 123 123 SER HA H 123 4.331 4.331 4.808 -0.477 18755
631 1 . 1 1 123 123 SER C C 123 174.000 174.000 173.940 0.060 18755
632 1 . 1 1 123 123 SER CA C 123 57.780 57.780 57.619 0.161 18755
633 1 . 1 1 123 123 SER CB C 123 63.720 63.720 65.443 -1.723 18755
634 1 . 1 1 123 123 SER H H 123 8.277 8.277 8.443 -0.166 18755
635 1 . 1 1 124 124 GLU N N 124 123.501 123.501 121.508 1.993 18755
636 1 . 1 1 124 124 GLU HA H 124 4.186 4.186 4.410 -0.224 18755
637 1 . 1 1 124 124 GLU C C 124 175.060 175.060 175.966 -0.906 18755
638 1 . 1 1 124 124 GLU CA C 124 56.200 56.200 56.647 -0.447 18755
639 1 . 1 1 124 124 GLU CB C 124 30.270 30.270 30.203 0.067 18755
640 1 . 1 1 124 124 GLU H H 124 8.378 8.378 8.736 -0.358 18755
stop_
save_